Mercurial > repos > bgruening > rxdock_rbcavity

annotate test-data/receptor.mol2 @ 0:e99f861ba68a draft

Find changesets by keywords (author, files, the commit message), revision number or hash, or revset expression.
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
author bgruening
date Sat, 04 Apr 2020 15:04:13 -0400
parents
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
0
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1 @<TRIPOS>MOLECULE
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2 receptor.pdb
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3 3013 3048 0 0 0
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4 SMALL
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5 GASTEIGER
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
7 @<TRIPOS>ATOM
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
8 1 N 16.0520 41.0190 15.4650 N.4 1 VAL1 0.2275
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
9 2 CA 15.2450 42.0270 14.7460 C.3 1 VAL1 0.0555
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
10 3 C 14.1180 41.2820 14.0050 C.2 1 VAL1 0.2618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
11 4 O 13.2440 40.5890 14.5350 O.2 1 VAL1 -0.2696
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
12 5 CB 16.0900 42.8220 13.7240 C.3 1 VAL1 0.0050
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
13 6 CG1 15.3310 44.0210 13.1490 C.3 1 VAL1 -0.0571
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
14 7 CG2 17.4520 43.2500 14.2510 C.3 1 VAL1 -0.0571
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
15 8 H1 16.8010 41.4790 15.9620 H 1 VAL1 0.2002
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
16 9 H2 15.4660 40.5250 16.1230 H 1 VAL1 0.2002
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
17 10 H3 16.4410 40.3630 14.8020 H 1 VAL1 0.2002
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
18 11 HA 14.8280 42.7360 15.4610 H 1 VAL1 0.0951
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
19 12 HB 16.4690 42.1440 12.9590 H 1 VAL1 0.0355
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
20 13 HG11 15.9670 44.5470 12.4370 H 1 VAL1 0.0234
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
21 14 HG12 14.4300 43.6730 12.6430 H 1 VAL1 0.0234
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
22 15 HG13 15.0550 44.6980 13.9570 H 1 VAL1 0.0234
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
23 16 HG21 17.9850 43.8020 13.4770 H 1 VAL1 0.0234
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
24 17 HG22 17.3200 43.8870 15.1250 H 1 VAL1 0.0234
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
25 18 HG23 18.0280 42.3680 14.5290 H 1 VAL1 0.0234
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
26 19 N 14.2650 41.4590 12.7080 N.am 2 GLY2 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
27 20 CA 13.3910 40.8770 11.6990 C.3 2 GLY2 0.0883
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
28 21 C 12.8860 42.0140 10.8100 C.2 2 GLY2 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
29 22 O 13.3350 43.1700 10.8420 O.2 2 GLY2 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
30 23 H 15.0220 42.0290 12.3590 H 2 GLY2 0.1494
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
31 24 HA2 13.9510 40.1530 11.1070 H 2 GLY2 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
32 25 HA3 12.5540 40.3770 12.1870 H 2 GLY2 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
33 26 N 11.9410 41.5950 10.0180 N.am 3 SER3 -0.3008
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
34 27 CA 11.2600 42.4710 9.0470 C.3 3 SER3 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
35 28 C 9.7770 42.0580 9.1450 C.2 3 SER3 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
36 29 O 9.5540 40.9440 9.6580 O.2 3 SER3 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
37 30 CB 11.8720 42.2070 7.6870 C.3 3 SER3 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
38 31 OG 12.1980 40.8290 7.5230 O.3 3 SER3 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
39 32 H 11.6440 40.6300 10.0520 H 3 SER3 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
40 33 HA 11.4250 43.5130 9.3190 H 3 SER3 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
41 34 HB2 11.1640 42.4900 6.9080 H 3 SER3 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
42 35 HB3 12.7840 42.7940 7.5780 H 3 SER3 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
43 36 HG 12.5830 40.6920 6.6540 H 3 SER3 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
44 37 N 8.9500 42.9530 8.6670 N.am 4 LEU4 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
45 38 CA 7.5000 42.7870 8.6020 C.3 4 LEU4 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
46 39 C 7.0610 42.3920 7.1710 C.2 4 LEU4 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
47 40 O 7.2180 43.2070 6.2410 O.2 4 LEU4 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
48 41 CB 6.8560 44.1050 8.9850 C.3 4 LEU4 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
49 42 CG 5.4220 44.0040 9.4470 C.3 4 LEU4 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
50 43 CD1 5.2730 42.9590 10.5730 C.3 4 LEU4 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
51 44 CD2 5.0360 45.3300 10.1100 C.3 4 LEU4 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
52 45 H 9.3050 43.8290 8.3110 H 4 LEU4 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
53 46 HA 7.1920 42.0030 9.2940 H 4 LEU4 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
54 47 HB2 7.4160 44.5590 9.8020 H 4 LEU4 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
55 48 HB3 6.8600 44.7750 8.1260 H 4 LEU4 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
56 49 HG 4.8070 43.6030 8.6410 H 4 LEU4 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
57 50 HD11 4.2300 42.9080 10.8860 H 4 LEU4 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
58 51 HD12 5.5910 41.9820 10.2070 H 4 LEU4 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
59 52 HD13 5.8930 43.2480 11.4220 H 4 LEU4 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
60 53 HD21 4.0020 45.2790 10.4520 H 4 LEU4 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
61 54 HD22 5.6910 45.5150 10.9620 H 4 LEU4 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
62 55 HD23 5.1400 46.1410 9.3890 H 4 LEU4 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
63 56 N 6.4950 41.1850 7.1120 N.am 5 ASN5 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
64 57 CA 6.1250 40.6700 5.7780 C.3 5 ASN5 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
65 58 C 4.6750 40.1940 5.7500 C.2 5 ASN5 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
66 59 O 4.2590 39.6530 6.8030 O.2 5 ASN5 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
67 60 CB 7.0560 39.4910 5.4700 C.3 5 ASN5 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
68 61 CG 8.5410 39.7470 5.5840 C.2 5 ASN5 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
69 62 OD1 9.0050 40.4410 4.6590 O.2 5 ASN5 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
70 63 ND2 9.1860 39.2610 6.6380 N.am 5 ASN5 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
71 64 H 6.3350 40.6600 7.9600 H 5 ASN5 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
72 65 HA 6.2400 41.4620 5.0380 H 5 ASN5 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
73 66 HB2 6.8450 38.6720 6.1570 H 5 ASN5 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
74 67 HB3 6.8930 39.1570 4.4460 H 5 ASN5 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
75 68 HD22 10.1790 39.4170 6.7390 H 5 ASN5 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
76 69 HD21 8.6840 38.7350 7.3390 H 5 ASN5 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
77 70 N 4.0250 40.3960 4.6420 N.am 6 CYS6 -0.3017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
78 71 CA 2.6590 39.9210 4.4400 C.3 6 CYS6 0.1081
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
79 72 C 2.7980 38.8070 3.3500 C.2 6 CYS6 0.2348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
80 73 O 3.5060 39.0540 2.3790 O.2 6 CYS6 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
81 74 CB 1.6490 40.9080 3.9260 C.3 6 CYS6 0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
82 75 SG 1.0660 42.1100 5.1800 S.3 6 CYS6 -0.1759
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
83 76 H 4.4640 40.8970 3.8830 H 6 CYS6 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
84 77 HA 2.2810 39.4940 5.3690 H 6 CYS6 0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
85 78 HB2 2.0860 41.4840 3.1100 H 6 CYS6 0.0397
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
86 79 HB3 0.7710 40.3740 3.5630 H 6 CYS6 0.0397
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
87 80 HG 0.1760 42.9380 4.6250 H 6 CYS6 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
88 81 N 2.0620 37.7150 3.5390 N.am 7 ILE7 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
89 82 CA 2.1030 36.6940 2.4630 C.3 7 ILE7 0.1020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
90 83 C 0.6370 36.4020 2.1680 C.2 7 ILE7 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
91 84 O -0.1770 36.1300 3.0680 O.2 7 ILE7 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
92 85 CB 3.0110 35.4750 2.8000 C.3 7 ILE7 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
93 86 CG1 3.1260 34.5150 1.5780 C.3 7 ILE7 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
94 87 CG2 2.4860 34.8160 4.1280 C.3 7 ILE7 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
95 88 CD1 4.2750 33.4600 1.7530 C.3 7 ILE7 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
96 89 H 1.5140 37.6150 4.3820 H 7 ILE7 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
97 90 HA 2.7440 37.0440 1.6540 H 7 ILE7 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
98 91 HB 3.9640 35.8290 3.1940 H 7 ILE7 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
99 92 HG12 2.1880 33.9740 1.4510 H 7 ILE7 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
100 93 HG13 3.3350 35.0940 0.6790 H 7 ILE7 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
101 94 HG21 3.1100 33.9590 4.3810 H 7 ILE7 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
102 95 HG22 2.5270 35.5450 4.9370 H 7 ILE7 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
103 96 HG23 1.4570 34.4860 3.9880 H 7 ILE7 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
104 97 HD11 4.3140 32.8150 0.8750 H 7 ILE7 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
105 98 HD12 5.2280 33.9760 1.8670 H 7 ILE7 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
106 99 HD13 4.0820 32.8550 2.6390 H 7 ILE7 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
107 100 N 0.3040 36.3240 0.8580 N.am 8 VAL8 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
108 101 CA -1.0920 36.0270 0.4580 C.3 8 VAL8 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
109 102 C -1.1750 35.3220 -0.9030 C.2 8 VAL8 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
110 103 O -0.2560 35.5460 -1.6990 O.2 8 VAL8 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
111 104 CB -1.8940 37.3520 0.4260 C.3 8 VAL8 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
112 105 CG1 -1.3370 38.3830 -0.5660 C.3 8 VAL8 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
113 106 CG2 -3.4190 37.0450 0.3330 C.3 8 VAL8 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
114 107 H 1.0080 36.4680 0.1480 H 8 VAL8 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
115 108 HA -1.5670 35.4130 1.2230 H 8 VAL8 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
116 109 HB -2.0710 37.6950 1.4450 H 8 VAL8 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
117 110 HG11 -1.9480 39.2850 -0.5350 H 8 VAL8 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
118 111 HG12 -0.3100 38.6300 -0.2960 H 8 VAL8 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
119 112 HG13 -1.3570 37.9660 -1.5730 H 8 VAL8 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
120 113 HG21 -3.9780 37.9810 0.3110 H 8 VAL8 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
121 114 HG22 -3.6220 36.4800 -0.5770 H 8 VAL8 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
122 115 HG23 -3.7260 36.4600 1.2000 H 8 VAL8 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
123 116 N -2.2040 34.5250 -1.1160 N.am 9 ALA9 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
124 117 CA -2.4720 33.9370 -2.4640 C.3 9 ALA9 0.0966
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
125 118 C -3.8430 34.5090 -2.8470 C.2 9 ALA9 0.2337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
126 119 O -4.7670 34.4470 -2.0160 O.2 9 ALA9 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
127 120 CB -2.4500 32.4310 -2.4980 C.3 9 ALA9 -0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
128 121 H -2.8330 34.2990 -0.3590 H 9 ALA9 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
129 122 HA -1.6640 34.2050 -3.1450 H 9 ALA9 0.0592
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
130 123 HB1 -2.6540 32.0870 -3.5120 H 9 ALA9 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
131 124 HB2 -1.4690 32.0740 -2.1840 H 9 ALA9 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
132 125 HB3 -3.2110 32.0410 -1.8230 H 9 ALA9 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
133 126 N -3.9680 35.1150 -4.0400 N.am 10 VAL10 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
134 127 CA -5.2050 35.7950 -4.4190 C.3 10 VAL10 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
135 128 C -5.6440 35.3950 -5.8360 C.2 10 VAL10 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
136 129 O -4.7420 35.3330 -6.6960 O.2 10 VAL10 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
137 130 CB -5.1980 37.3410 -4.4450 C.3 10 VAL10 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
138 131 CG1 -5.2810 38.0400 -3.1280 C.3 10 VAL10 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
139 132 CG2 -4.0500 38.0000 -5.2310 C.3 10 VAL10 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
140 133 H -3.1980 35.1060 -4.6940 H 10 VAL10 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
141 134 HA -5.9970 35.5270 -3.7190 H 10 VAL10 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
142 135 HB -5.9660 37.6970 -5.1320 H 10 VAL10 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
143 136 HG11 -5.2670 39.1180 -3.2870 H 10 VAL10 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
144 137 HG12 -6.2060 37.7590 -2.6250 H 10 VAL10 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
145 138 HG13 -4.4300 37.7530 -2.5100 H 10 VAL10 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
146 139 HG21 -4.1490 39.0840 -5.1790 H 10 VAL10 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
147 140 HG22 -3.0950 37.7020 -4.7990 H 10 VAL10 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
148 141 HG23 -4.0920 37.6810 -6.2730 H 10 VAL10 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
149 142 N -6.9490 35.2940 -5.9760 N.am 11 SER11 -0.3006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
150 143 CA -7.5190 35.0230 -7.3080 C.3 11 SER11 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
151 144 C -7.5200 36.3890 -8.0470 C.2 11 SER11 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
152 145 O -7.2370 37.4970 -7.5380 O.2 11 SER11 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
153 146 CB -8.9110 34.3880 -7.1730 C.3 11 SER11 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
154 147 OG -9.7030 35.4180 -6.6270 O.3 11 SER11 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
155 148 H -7.5530 35.4020 -5.1740 H 11 SER11 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
156 149 HA -6.9350 34.2470 -7.8020 H 11 SER11 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
157 150 HB2 -9.2650 34.0750 -8.1550 H 11 SER11 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
158 151 HB3 -8.8530 33.5210 -6.5150 H 11 SER11 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
159 152 HG -10.6020 35.1020 -6.5080 H 11 SER11 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
160 153 N -7.8410 36.3160 -9.3280 N.am 12 GLN12 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
161 154 CA -7.9180 37.5160 -10.1900 C.3 12 GLN12 0.0999
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
162 155 C -8.9150 38.5200 -9.6940 C.2 12 GLN12 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
163 156 O -8.6630 39.7110 -9.8530 O.2 12 GLN12 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
164 157 CB -8.4160 37.1770 -11.6330 C.3 12 GLN12 -0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
165 158 CG -7.2990 36.5920 -12.4320 C.3 12 GLN12 0.0259
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
166 159 CD -7.5910 36.4870 -13.9250 C.2 12 GLN12 0.2106
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
167 160 OE1 -6.5480 36.3350 -14.5780 O.2 12 GLN12 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
168 161 NE2 -8.8500 36.5760 -14.3580 N.am 12 GLN12 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
169 162 H -8.0430 35.4200 -9.7480 H 12 GLN12 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
170 163 HA -6.9590 38.0340 -10.1780 H 12 GLN12 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
171 164 HB2 -9.2320 36.4570 -11.5760 H 12 GLN12 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
172 165 HB3 -8.7680 38.0870 -12.1200 H 12 GLN12 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
173 166 HG2 -6.4090 37.2120 -12.3220 H 12 GLN12 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
174 167 HG3 -7.0850 35.5840 -12.0750 H 12 GLN12 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
175 168 HE22 -9.0500 36.5070 -15.3460 H 12 GLN12 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
176 169 HE21 -9.6030 36.7120 -13.6980 H 12 GLN12 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
177 170 N -9.9870 37.9780 -9.1100 N.am 13 ASN13 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
178 171 CA -11.0610 38.8040 -8.5040 C.3 13 ASN13 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
179 172 C -10.7420 39.1450 -7.0510 C.2 13 ASN13 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
180 173 O -11.6490 39.5160 -6.3190 O.2 13 ASN13 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
181 174 CB -12.4740 38.2140 -8.6710 C.3 13 ASN13 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
182 175 CG -12.6440 36.8220 -8.1070 C.2 13 ASN13 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
183 176 OD1 -11.7210 35.9630 -8.2680 O.2 13 ASN13 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
184 177 ND2 -13.7230 36.4640 -7.3740 N.am 13 ASN13 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
185 178 H -10.0870 36.9740 -9.0700 H 13 ASN13 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
186 179 HA -11.2660 39.6610 -9.1450 H 13 ASN13 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
187 180 HB2 -13.1970 38.8520 -8.1620 H 13 ASN13 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
188 181 HB3 -12.7220 38.1580 -9.7310 H 13 ASN13 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
189 182 HD22 -13.8000 35.5230 -7.0150 H 13 ASN13 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
190 183 HD21 -14.4520 37.1370 -7.1860 H 13 ASN13 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
191 184 N -9.5000 39.0480 -6.6200 N.am 14 MET14 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
192 185 CA -8.8780 39.3730 -5.3540 C.3 14 MET14 0.1001
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
193 186 C -9.4150 38.5270 -4.1770 C.2 14 MET14 0.2338
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
194 187 O -9.3500 39.0110 -3.0400 O.2 14 MET14 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
195 188 CB -9.0280 40.8470 -4.9100 C.3 14 MET14 -0.0169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
196 189 CG -8.5850 41.8950 -5.9250 C.3 14 MET14 -0.0044
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
197 190 SD -6.7660 41.7330 -6.0760 S.3 14 MET14 -0.1641
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
198 191 CE -6.2730 42.6900 -4.6090 C.3 14 MET14 -0.0181
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
199 192 H -8.7810 38.6860 -7.2300 H 14 MET14 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
200 193 HA -7.8010 39.2260 -5.4300 H 14 MET14 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
201 194 HB2 -10.0750 41.0570 -4.6940 H 14 MET14 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
202 195 HB3 -8.4310 41.0200 -4.0150 H 14 MET14 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
203 196 HG2 -9.0740 41.7060 -6.8810 H 14 MET14 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
204 197 HG3 -8.8600 42.8870 -5.5670 H 14 MET14 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
205 198 HE1 -5.1860 42.7040 -4.5320 H 14 MET14 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
206 199 HE2 -6.6440 43.7110 -4.6990 H 14 MET14 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
207 200 HE3 -6.6940 42.2290 -3.7150 H 14 MET14 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
208 201 N -9.9000 37.3560 -4.4100 N.am 15 GLY15 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
209 202 CA -10.4650 36.4260 -3.4050 C.3 15 GLY15 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
210 203 C -9.3530 35.6360 -2.6760 C.2 15 GLY15 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
211 204 O -8.3990 35.2800 -3.3430 O.2 15 GLY15 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
212 205 H -9.9180 36.9950 -5.3530 H 15 GLY15 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
213 206 HA2 -11.0290 36.9910 -2.6630 H 15 GLY15 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
214 207 HA3 -11.1260 35.7140 -3.8990 H 15 GLY15 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
215 208 N -9.5540 35.4600 -1.3790 N.am 16 ILE16 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
216 209 CA -8.5410 34.6510 -0.6330 C.3 16 ILE16 0.1019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
217 210 C -9.2760 33.5460 0.1460 C.2 16 ILE16 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
218 211 O -8.5740 32.6750 0.7220 O.2 16 ILE16 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
219 212 CB -7.7490 35.6140 0.2970 C.3 16 ILE16 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
220 213 CG1 -8.6380 36.2580 1.4160 C.3 16 ILE16 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
221 214 CG2 -6.9600 36.7200 -0.4470 C.3 16 ILE16 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
222 215 CD1 -7.9090 37.1470 2.4610 C.3 16 ILE16 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
223 216 H -10.3650 35.8650 -0.9340 H 16 ILE16 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
224 217 HA -7.8160 34.2390 -1.3350 H 16 ILE16 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
225 218 HB -6.8750 35.0980 0.6960 H 16 ILE16 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
226 219 HG12 -9.3920 36.8980 0.9580 H 16 ILE16 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
227 220 HG13 -9.1290 35.4710 1.9890 H 16 ILE16 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
228 221 HG21 -6.4380 37.3450 0.2780 H 16 ILE16 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
229 222 HG22 -6.2350 36.2600 -1.1190 H 16 ILE16 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
230 223 HG23 -7.6510 37.3340 -1.0240 H 16 ILE16 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
231 224 HD11 -8.6330 37.5320 3.1790 H 16 ILE16 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
232 225 HD12 -7.1590 36.5530 2.9840 H 16 ILE16 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
233 226 HD13 -7.4230 37.9800 1.9540 H 16 ILE16 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
234 227 N -10.5920 33.5280 0.2070 N.am 17 GLY17 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
235 228 CA -11.2420 32.4400 1.0020 C.3 17 GLY17 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
236 229 C -12.7130 32.3180 0.5190 C.2 17 GLY17 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
237 230 O -13.2850 33.2150 -0.1070 O.2 17 GLY17 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
238 231 H -11.1300 34.2350 -0.2740 H 17 GLY17 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
239 232 HA2 -10.7100 31.5030 0.8390 H 17 GLY17 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
240 233 HA3 -11.2110 32.6950 2.0610 H 17 GLY17 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
241 234 N -13.2520 31.1730 0.8650 N.am 18 LYS18 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
242 235 CA -14.6680 30.8450 0.5820 C.3 18 LYS18 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
243 236 C -15.1440 29.8300 1.5960 C.2 18 LYS18 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
244 237 O -14.6090 28.7260 1.5430 O.2 18 LYS18 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
245 238 CB -14.6840 30.3360 -0.8650 C.3 18 LYS18 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
246 239 CG -16.1060 29.8890 -1.3160 C.3 18 LYS18 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
247 240 CD -17.1540 30.9590 -1.2560 C.3 18 LYS18 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
248 241 CE -18.4760 30.3270 -1.7990 C.3 18 LYS18 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
249 242 NZ -19.4700 31.4210 -1.8490 N.4 18 LYS18 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
250 243 H -12.6970 30.4770 1.3430 H 18 LYS18 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
251 244 HA -15.2650 31.7570 0.6080 H 18 LYS18 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
252 245 HB2 -14.3510 31.1300 -1.5340 H 18 LYS18 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
253 246 HB3 -14.0150 29.4800 -0.9570 H 18 LYS18 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
254 247 HG2 -16.0690 29.5460 -2.3500 H 18 LYS18 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
255 248 HG3 -16.4520 29.0770 -0.6770 H 18 LYS18 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
256 249 HD2 -17.2780 31.2890 -0.2250 H 18 LYS18 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
257 250 HD3 -16.8470 31.8040 -1.8730 H 18 LYS18 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
258 251 HE2 -18.3000 29.9130 -2.7920 H 18 LYS18 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
259 252 HE3 -18.8020 29.5330 -1.1270 H 18 LYS18 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
260 253 HZ1 -20.3480 31.0630 -2.1960 H 18 LYS18 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
261 254 HZ2 -19.6030 31.7980 -0.9220 H 18 LYS18 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
262 255 HZ3 -19.1380 32.1500 -2.4640 H 18 LYS18 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
263 256 N -16.1300 30.1500 2.3750 N.am 19 ASN19 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
264 257 CA -16.6850 29.2550 3.4430 C.3 19 ASN19 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
265 258 C -15.6450 28.5330 4.3000 C.2 19 ASN19 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
266 259 O -15.8160 27.3460 4.5840 O.2 19 ASN19 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
267 260 CB -17.6500 28.2570 2.8150 C.3 19 ASN19 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
268 261 CG -18.8790 28.9800 2.3080 C.2 19 ASN19 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
269 262 OD1 -19.4200 29.7750 3.0700 O.2 19 ASN19 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
270 263 ND2 -19.3210 28.7390 1.0750 N.am 19 ASN19 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
271 264 H -16.5740 31.0520 2.2820 H 19 ASN19 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
272 265 HA -17.3720 29.8210 4.0710 H 19 ASN19 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
273 266 HB2 -17.1600 27.7520 1.9820 H 19 ASN19 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
274 267 HB3 -17.9480 27.5200 3.5610 H 19 ASN19 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
275 268 HD22 -20.1410 29.2180 0.7300 H 19 ASN19 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
276 269 HD21 -18.8370 28.0770 0.4850 H 19 ASN19 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
277 270 N -14.5590 29.1230 4.7110 N.am 20 GLY20 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
278 271 CA -13.6000 28.3720 5.5500 C.3 20 GLY20 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
279 272 C -12.5320 27.6300 4.7770 C.2 20 GLY20 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
280 273 O -11.6410 27.0250 5.4020 O.2 20 GLY20 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
281 274 H -14.3790 30.0840 4.4560 H 20 GLY20 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
282 275 HA2 -13.0840 29.0610 6.2180 H 20 GLY20 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
283 276 HA3 -14.1370 27.6280 6.1390 H 20 GLY20 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
284 277 N -12.4740 27.7280 3.4430 N.am 21 ASP21 -0.3023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
285 278 CA -11.4140 27.0050 2.7100 C.3 21 ASP21 0.1052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
286 279 C -10.8650 27.9890 1.6800 C.2 21 ASP21 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
287 280 O -11.2860 29.1620 1.6840 O.2 21 ASP21 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
288 281 CB -12.0650 25.7640 2.1330 C.3 21 ASP21 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
289 282 CG -11.0180 24.7210 1.7570 C.2 21 ASP21 0.0893
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
290 283 OD1 -9.8020 24.8340 1.7070 O.co2 21 ASP21 -0.3089
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
291 284 OD2 -11.4990 23.6010 1.5280 O.co2 21 ASP21 -0.8475
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
292 285 H -13.1500 28.2920 2.9480 H 21 ASP21 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
293 286 HA -10.6650 26.6450 3.4150 H 21 ASP21 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
294 287 HB2 -12.7400 25.3310 2.8710 H 21 ASP21 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
295 288 HB3 -12.6280 26.0310 1.2390 H 21 ASP21 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
296 289 N -9.9870 27.5170 0.8400 N.am 22 LEU22 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
297 290 CA -9.4490 28.3660 -0.2540 C.3 22 LEU22 0.0999
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
298 291 C -10.5340 28.3040 -1.3640 C.2 22 LEU22 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
299 292 O -11.2130 27.2780 -1.5450 O.2 22 LEU22 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
300 293 CB -8.1930 27.6950 -0.7820 C.3 22 LEU22 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
301 294 CG -6.8180 27.9060 -0.1570 C.3 22 LEU22 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
302 295 CD1 -6.8410 28.6780 1.1040 C.3 22 LEU22 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
303 296 CD2 -6.1460 26.5480 -0.0890 C.3 22 LEU22 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
304 297 H -9.6650 26.5640 0.9290 H 22 LEU22 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
305 298 HA -9.3870 29.4000 0.0850 H 22 LEU22 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
306 299 HB2 -8.3100 26.6120 -0.7310 H 22 LEU22 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
307 300 HB3 -8.0280 27.9940 -1.8170 H 22 LEU22 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
308 301 HG -6.1320 28.2950 -0.9100 H 22 LEU22 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
309 302 HD11 -5.8250 28.7840 1.4840 H 22 LEU22 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
310 303 HD12 -7.2640 29.6650 0.9190 H 22 LEU22 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
311 304 HD13 -7.4510 28.1540 1.8400 H 22 LEU22 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
312 305 HD21 -5.1560 26.6540 0.3540 H 22 LEU22 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
313 306 HD22 -6.7470 25.8750 0.5230 H 22 LEU22 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
314 307 HD23 -6.0520 26.1380 -1.0940 H 22 LEU22 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
315 308 N -10.5190 29.3510 -2.1890 N.am 23 PRO23 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
316 309 CA -11.4800 29.4240 -3.3160 C.3 23 PRO23 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
317 310 C -11.1950 28.3770 -4.4110 C.2 23 PRO23 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
318 311 O -12.1190 27.9210 -5.1000 O.2 23 PRO23 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
319 312 CB -11.3640 30.8630 -3.7950 C.3 23 PRO23 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
320 313 CG -10.8400 31.6230 -2.5660 C.3 23 PRO23 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
321 314 CD -9.7640 30.5980 -2.0570 C.3 23 PRO23 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
322 315 HA -12.4960 29.3150 -2.9360 H 23 PRO23 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
323 316 HB2 -10.6700 30.9120 -4.6340 H 23 PRO23 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
324 317 HB3 -12.3430 31.2210 -4.1120 H 23 PRO23 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
325 318 HG2 -10.4270 32.5820 -2.8800 H 23 PRO23 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
326 319 HG3 -11.6590 31.7920 -1.8660 H 23 PRO23 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
327 320 HD3 -9.4750 30.7400 -1.0160 H 23 PRO23 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
328 321 HD2 -8.8700 30.5490 -2.6780 H 23 PRO23 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
329 322 N -9.9500 28.0200 -4.5600 N.am 24 TRP24 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
330 323 CA -9.4570 27.0970 -5.6100 C.3 24 TRP24 0.1036
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
331 324 C -9.1710 25.7170 -5.0330 C.2 24 TRP24 0.2368
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
332 325 O -9.0500 25.5330 -3.8060 O.2 24 TRP24 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
333 326 CB -8.1690 27.7070 -6.1930 C.3 24 TRP24 0.0013
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
334 327 CG -7.2300 28.3120 -5.1770 C.ar 24 TRP24 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
335 328 CD1 -6.2200 27.6840 -4.5040 C.ar 24 TRP24 0.0060
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
336 329 CD2 -7.2060 29.6990 -4.7500 C.ar 24 TRP24 0.0029
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
337 330 NE1 -5.5570 28.5400 -3.6730 N.ar 24 TRP24 -0.3604
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
338 331 CE2 -6.1760 29.7890 -3.7650 C.ar 24 TRP24 0.0467
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
339 332 CE3 -7.9220 30.8530 -5.0670 C.ar 24 TRP24 -0.0523
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
340 333 CZ2 -5.8330 30.9650 -3.1340 C.ar 24 TRP24 -0.0378
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
341 334 CZ3 -7.6400 32.0480 -4.3830 C.ar 24 TRP24 -0.0611
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
342 335 CH2 -6.5520 32.0960 -3.4530 C.ar 24 TRP24 -0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
343 336 H -9.2430 28.3780 -3.9330 H 24 TRP24 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
344 337 HA -10.2060 27.0070 -6.3960 H 24 TRP24 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
345 338 HB2 -7.6050 26.9350 -6.7160 H 24 TRP24 0.0337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
346 339 HB3 -8.4270 28.5040 -6.8910 H 24 TRP24 0.0337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
347 340 HD1 -6.0340 26.6330 -4.6670 H 24 TRP24 0.0810
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
348 341 HE1 -4.7680 28.2110 -3.1340 H 24 TRP24 0.1653
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
349 342 HE3 -8.6840 30.8230 -5.8310 H 24 TRP24 0.0624
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
350 343 HZ2 -5.0250 30.9780 -2.4170 H 24 TRP24 0.0638
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
351 344 HZ3 -8.2430 32.9260 -4.5590 H 24 TRP24 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
352 345 HH2 -6.2990 33.0430 -2.9990 H 24 TRP24 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
353 346 N -8.9670 24.7430 -5.9120 N.am 25 PRO25 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
354 347 CA -8.5770 23.3990 -5.4620 C.3 25 PRO25 0.1025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
355 348 C -7.1350 23.5300 -4.9140 C.2 25 PRO25 0.2367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
356 349 O -6.4220 24.5210 -5.2530 O.2 25 PRO25 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
357 350 CB -8.5540 22.5580 -6.7400 C.3 25 PRO25 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
358 351 CG -8.9390 23.4640 -7.8420 C.3 25 PRO25 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
359 352 CD -9.0890 24.8960 -7.3820 C.3 25 PRO25 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
360 353 HA -9.2110 23.0960 -4.6290 H 25 PRO25 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
361 354 HB2 -7.5520 22.1590 -6.8950 H 25 PRO25 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
362 355 HB3 -9.2620 21.7340 -6.6460 H 25 PRO25 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
363 356 HG2 -8.1750 23.4380 -8.6190 H 25 PRO25 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
364 357 HG3 -9.8930 23.1430 -8.2610 H 25 PRO25 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
365 358 HD3 -10.0600 25.3280 -7.6230 H 25 PRO25 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
366 359 HD2 -8.2990 25.5520 -7.7460 H 25 PRO25 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
367 360 N -6.7290 22.5470 -4.1210 N.am 26 PRO26 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
368 361 CA -5.4030 22.5150 -3.5330 C.3 26 PRO26 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
369 362 C -4.2920 22.5910 -4.5760 C.2 26 PRO26 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
370 363 O -4.3540 21.7900 -5.5270 O.2 26 PRO26 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
371 364 CB -5.3060 21.2310 -2.7400 C.3 26 PRO26 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
372 365 CG -6.6020 20.5220 -2.9260 C.3 26 PRO26 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
373 366 CD -7.5330 21.3600 -3.7780 C.3 26 PRO26 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
374 367 HA -5.2960 23.3430 -2.8320 H 26 PRO26 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
375 368 HB2 -4.4770 20.6320 -3.1170 H 26 PRO26 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
376 369 HB3 -5.1370 21.4640 -1.6890 H 26 PRO26 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
377 370 HG2 -6.4260 19.5670 -3.4200 H 26 PRO26 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
378 371 HG3 -7.0640 20.3480 -1.9540 H 26 PRO26 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
379 372 HD3 -8.4240 21.6690 -3.2310 H 26 PRO26 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
380 373 HD2 -7.8290 20.8450 -4.6920 H 26 PRO26 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
381 374 N -3.3670 23.5050 -4.3490 N.am 27 LEU27 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
382 375 CA -2.2210 23.7100 -5.2140 C.3 27 LEU27 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
383 376 C -1.0240 23.3390 -4.3310 C.2 27 LEU27 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
384 377 O -0.5560 24.1560 -3.5340 O.2 27 LEU27 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
385 378 CB -2.1080 25.1120 -5.7680 C.3 27 LEU27 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
386 379 CG -3.2310 25.7100 -6.6420 C.3 27 LEU27 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
387 380 CD1 -2.8810 27.1560 -6.9790 C.3 27 LEU27 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
388 381 CD2 -3.3970 24.7710 -7.8680 C.3 27 LEU27 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
389 382 H -3.4370 24.1050 -3.5390 H 27 LEU27 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
390 383 HA -2.3250 23.0950 -6.1080 H 27 LEU27 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
391 384 HB2 -2.0200 25.8220 -4.9460 H 27 LEU27 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
392 385 HB3 -1.2260 25.1820 -6.4040 H 27 LEU27 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
393 386 HG -4.1880 25.5990 -6.1310 H 27 LEU27 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
394 387 HD11 -3.6690 27.5870 -7.5970 H 27 LEU27 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
395 388 HD12 -2.7860 27.7320 -6.0580 H 27 LEU27 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
396 389 HD13 -1.9370 27.1840 -7.5230 H 27 LEU27 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
397 390 HD21 -4.1840 25.1560 -8.5170 H 27 LEU27 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
398 391 HD22 -2.4590 24.7270 -8.4220 H 27 LEU27 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
399 392 HD23 -3.6650 23.7710 -7.5270 H 27 LEU27 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
400 393 N -0.5110 22.1390 -4.5160 N.am 28 ARG28 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
401 394 CA 0.6040 21.6440 -3.6900 C.3 28 ARG28 0.0995
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
402 395 C 1.8730 22.4450 -3.6590 C.2 28 ARG28 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
403 396 O 2.3410 22.5120 -2.5120 O.2 28 ARG28 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
404 397 CB 0.8450 20.1320 -3.9510 C.3 28 ARG28 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
405 398 CG -0.5740 19.5230 -3.8610 C.3 28 ARG28 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
406 399 CD -0.6260 18.1250 -3.3340 C.3 28 ARG28 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
407 400 NE -1.9990 17.5960 -3.2460 N.pl3 28 ARG28 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
408 401 CZ -2.7180 16.9960 -4.1990 C.cat 28 ARG28 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
409 402 NH1 -4.0020 16.6550 -4.0090 N.pl3 28 ARG28 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
410 403 NH2 -2.1220 16.6950 -5.3610 N.pl3 28 ARG28 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
411 404 H -0.8820 21.5370 -5.2370 H 28 ARG28 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
412 405 HA 0.2320 21.3720 -2.7020 H 28 ARG28 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
413 406 HB2 1.2920 20.0000 -4.9360 H 28 ARG28 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
414 407 HB3 1.5170 19.7340 -3.1910 H 28 ARG28 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
415 408 HG2 -1.1890 20.1310 -3.1980 H 28 ARG28 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
416 409 HG3 -1.0240 19.5000 -4.8540 H 28 ARG28 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
417 410 HD2 -0.0580 17.4670 -3.9920 H 28 ARG28 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
418 411 HD3 -0.1950 18.0970 -2.3330 H 28 ARG28 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
419 412 HE -2.3940 17.7330 -2.3260 H 28 ARG28 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
420 413 HH12 -4.5190 16.2020 -4.7490 H 28 ARG28 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
421 414 HH11 -4.4510 16.8510 -3.1260 H 28 ARG28 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
422 415 HH22 -2.6470 16.2410 -6.0950 H 28 ARG28 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
423 416 HH21 -1.1480 16.9220 -5.5030 H 28 ARG28 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
424 417 N 2.3770 22.9730 -4.7130 N.am 29 ASN29 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
425 418 CA 3.5630 23.7610 -4.7480 C.3 29 ASN29 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
426 419 C 3.2390 25.1630 -4.1580 C.2 29 ASN29 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
427 420 O 4.2720 25.7250 -3.8280 O.2 29 ASN29 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
428 421 CB 4.2390 23.8760 -6.1140 C.3 29 ASN29 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
429 422 CG 4.7150 22.4670 -6.5240 C.2 29 ASN29 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
430 423 OD1 5.3120 21.7340 -5.7320 O.2 29 ASN29 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
431 424 ND2 4.3800 22.0290 -7.7250 N.am 29 ASN29 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
432 425 H 1.9270 22.8430 -5.6080 H 29 ASN29 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
433 426 HA 4.3680 23.2290 -4.2410 H 29 ASN29 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
434 427 HB2 3.5250 24.2610 -6.8420 H 29 ASN29 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
435 428 HB3 5.0880 24.5560 -6.0440 H 29 ASN29 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
436 429 HD22 4.6740 21.1110 -8.0280 H 29 ASN29 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
437 430 HD21 3.8300 22.6120 -8.3400 H 29 ASN29 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
438 431 N 1.9800 25.5620 -4.1360 N.am 30 GLU30 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
439 432 CA 1.7130 26.9030 -3.5380 C.3 30 GLU30 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
440 433 C 1.8340 26.7490 -1.9990 C.2 30 GLU30 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
441 434 O 2.4510 27.5680 -1.3460 O.2 30 GLU30 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
442 435 CB 0.3320 27.4100 -3.9180 C.3 30 GLU30 -0.0209
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
443 436 CG 0.2390 28.9810 -4.0900 C.3 30 GLU30 -0.0111
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
444 437 CD 0.3390 29.7350 -2.7670 C.2 30 GLU30 0.0418
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
445 438 OE1 1.0730 30.7060 -2.6770 O.co2 30 GLU30 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
446 439 OE2 -0.4060 29.2960 -1.8760 O.co2 30 GLU30 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
447 440 H 1.2550 24.9680 -4.5120 H 30 GLU30 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
448 441 HA 2.4340 27.6240 -3.9240 H 30 GLU30 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
449 442 HB2 0.0300 26.9670 -4.8670 H 30 GLU30 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
450 443 HB3 -0.3830 27.1320 -3.1440 H 30 GLU30 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
451 444 HG2 1.0520 29.3260 -4.7290 H 30 GLU30 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
452 445 HG3 -0.7160 29.2410 -4.5470 H 30 GLU30 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
453 446 N 1.2990 25.6680 -1.5420 N.am 31 PHE31 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
454 447 CA 1.3330 25.2890 -0.1010 C.3 31 PHE31 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
455 448 C 2.8420 25.1690 0.2590 C.2 31 PHE31 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
456 449 O 3.2220 25.6220 1.3340 O.2 31 PHE31 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
457 450 CB 0.5760 24.0720 0.3110 C.3 31 PHE31 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
458 451 CG -0.9300 24.0660 0.3480 C.ar 31 PHE31 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
459 452 CD1 -1.6290 23.1140 -0.3860 C.ar 31 PHE31 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
460 453 CD2 -1.5910 24.9930 1.1550 C.ar 31 PHE31 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
461 454 CE1 -3.0180 23.0370 -0.3710 C.ar 31 PHE31 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
462 455 CE2 -3.0090 24.9490 1.1720 C.ar 31 PHE31 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
463 456 CZ -3.6740 23.9950 0.4250 C.ar 31 PHE31 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
464 457 H 0.8290 25.0320 -2.1710 H 31 PHE31 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
465 458 HA 0.7680 26.0180 0.4800 H 31 PHE31 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
466 459 HB2 0.8140 23.2500 -0.3640 H 31 PHE31 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
467 460 HB3 0.8530 23.7980 1.3290 H 31 PHE31 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
468 461 HD1 -1.0930 22.4010 -0.9950 H 31 PHE31 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
469 462 HD2 -1.0230 25.7060 1.7350 H 31 PHE31 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
470 463 HE1 -3.5230 22.2760 -0.9470 H 31 PHE31 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
471 464 HE2 -3.5640 25.6590 1.7670 H 31 PHE31 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
472 465 HZ -4.7530 24.0090 0.4740 H 31 PHE31 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
473 466 N 3.6380 24.5340 -0.5980 N.am 32 ARG32 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
474 467 CA 5.0520 24.3430 -0.3130 C.3 32 ARG32 0.0995
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
475 468 C 5.8020 25.6630 -0.2540 C.2 32 ARG32 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
476 469 O 6.6940 25.7070 0.6160 O.2 32 ARG32 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
477 470 CB 5.7780 23.3630 -1.2790 C.3 32 ARG32 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
478 471 CG 5.2630 21.9350 -1.1240 C.3 32 ARG32 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
479 472 CD 5.8520 21.2710 0.0820 C.3 32 ARG32 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
480 473 NE 7.1970 21.8200 0.3170 N.pl3 32 ARG32 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
481 474 CZ 7.6030 22.5010 1.3860 C.cat 32 ARG32 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
482 475 NH1 8.7910 23.1150 1.3210 N.pl3 32 ARG32 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
483 476 NH2 6.9000 22.5450 2.5030 N.pl3 32 ARG32 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
484 477 H 3.2630 24.1750 -1.4640 H 32 ARG32 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
485 478 HA 5.1630 23.7510 0.5960 H 32 ARG32 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
486 479 HB2 5.6120 23.6780 -2.3090 H 32 ARG32 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
487 480 HB3 6.8470 23.3670 -1.0660 H 32 ARG32 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
488 481 HG2 4.1780 21.9490 -1.0160 H 32 ARG32 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
489 482 HG3 5.5330 21.3530 -2.0060 H 32 ARG32 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
490 483 HD2 5.2190 21.4620 0.9480 H 32 ARG32 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
491 484 HD3 5.9170 20.1970 -0.0900 H 32 ARG32 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
492 485 HE 7.8410 21.6350 -0.4380 H 32 ARG32 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
493 486 HH12 9.1320 23.6410 2.1130 H 32 ARG32 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
494 487 HH11 9.3470 23.0520 0.4800 H 32 ARG32 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
495 488 HH22 7.2410 23.0730 3.2940 H 32 ARG32 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
496 489 HH21 6.0210 22.0510 2.5670 H 32 ARG32 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
497 490 N 5.4180 26.6150 -1.0860 N.am 33 TYR33 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
498 491 CA 6.0900 27.9220 -1.1420 C.3 33 TYR33 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
499 492 C 5.7240 28.6570 0.1660 C.2 33 TYR33 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
500 493 O 6.5800 29.2090 0.8550 O.2 33 TYR33 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
501 494 CB 5.6050 28.7530 -2.3480 C.3 33 TYR33 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
502 495 CG 5.8880 30.2020 -2.3780 C.ar 33 TYR33 -0.0449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
503 496 CD1 4.9610 31.2340 -1.9850 C.ar 33 TYR33 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
504 497 CD2 7.2020 30.5450 -2.7800 C.ar 33 TYR33 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
505 498 CE1 5.4300 32.5590 -2.0830 C.ar 33 TYR33 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
506 499 CE2 7.6160 31.8520 -2.8870 C.ar 33 TYR33 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
507 500 CZ 6.6980 32.8400 -2.5490 C.ar 33 TYR33 0.1169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
508 501 OH 7.1800 34.1260 -2.7220 O.3 33 TYR33 -0.5068
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
509 502 H 4.6400 26.4570 -1.7100 H 33 TYR33 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
510 503 HA 7.1680 27.7740 -1.2020 H 33 TYR33 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
511 504 HB2 6.0580 28.3670 -3.2610 H 33 TYR33 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
512 505 HB3 4.5200 28.6850 -2.4240 H 33 TYR33 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
513 506 HD1 3.9720 30.9690 -1.6400 H 33 TYR33 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
514 507 HD2 7.9150 29.7680 -3.0140 H 33 TYR33 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
515 508 HE1 4.7930 33.3800 -1.7900 H 33 TYR33 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
516 509 HE2 8.6180 32.0750 -3.2220 H 33 TYR33 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
517 510 HH 8.0800 34.0890 -3.0540 H 33 TYR33 0.2921
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
518 511 N 4.4770 28.5440 0.5060 N.am 34 PHE34 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
519 512 CA 3.9770 29.2040 1.7440 C.3 34 PHE34 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
520 513 C 4.7830 28.6150 2.9420 C.2 34 PHE34 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
521 514 O 5.2220 29.4390 3.7190 O.2 34 PHE34 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
522 515 CB 2.4780 29.0150 1.9660 C.3 34 PHE34 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
523 516 CG 1.9910 29.3920 3.3340 C.ar 34 PHE34 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
524 517 CD1 1.7270 30.7420 3.6590 C.ar 34 PHE34 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
525 518 CD2 1.7970 28.3640 4.2990 C.ar 34 PHE34 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
526 519 CE1 1.3180 31.0710 4.9590 C.ar 34 PHE34 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
527 520 CE2 1.3870 28.7230 5.5850 C.ar 34 PHE34 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
528 521 CZ 1.1330 30.0840 5.9130 C.ar 34 PHE34 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
529 522 H 3.8430 28.0080 -0.0690 H 34 PHE34 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
530 523 HA 4.0980 30.2840 1.6550 H 34 PHE34 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
531 524 HB2 1.9250 29.6300 1.2560 H 34 PHE34 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
532 525 HB3 2.2180 27.9670 1.8190 H 34 PHE34 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
533 526 HD1 1.8410 31.5100 2.9090 H 34 PHE34 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
534 527 HD2 1.9670 27.3320 4.0300 H 34 PHE34 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
535 528 HE1 1.1440 32.1030 5.2250 H 34 PHE34 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
536 529 HE2 1.2600 27.9640 6.3430 H 34 PHE34 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
537 530 HZ 0.7960 30.3480 6.9050 H 34 PHE34 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
538 531 N 4.8310 27.3300 3.0410 N.am 35 GLN35 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
539 532 CA 5.5090 26.6760 4.2140 C.3 35 GLN35 0.0999
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
540 533 C 6.9630 27.0770 4.2070 C.2 35 GLN35 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
541 534 O 7.5180 27.4790 5.2540 O.2 35 GLN35 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
542 535 CB 5.3110 25.1540 4.1330 C.3 35 GLN35 -0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
543 536 CG 3.8560 24.7170 4.2270 C.3 35 GLN35 0.0259
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
544 537 CD 3.4050 24.5730 5.6660 C.2 35 GLN35 0.2106
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
545 538 OE1 2.8180 23.5530 6.1020 O.2 35 GLN35 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
546 539 NE2 3.5930 25.6200 6.4050 N.am 35 GLN35 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
547 540 H 4.4110 26.7520 2.3270 H 35 GLN35 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
548 541 HA 4.9990 26.9600 5.1340 H 35 GLN35 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
549 542 HB2 5.6980 24.7870 3.1820 H 35 GLN35 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
550 543 HB3 5.8460 24.6730 4.9520 H 35 GLN35 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
551 544 HG2 3.2210 25.4590 3.7420 H 35 GLN35 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
552 545 HG3 3.7330 23.7540 3.7320 H 35 GLN35 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
553 546 HE22 3.3200 25.6070 7.3770 H 35 GLN35 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
554 547 HE21 4.0130 26.4490 6.0090 H 35 GLN35 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
555 548 N 7.6330 26.9990 3.0730 N.am 36 ARG36 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
556 549 CA 9.0660 27.3390 3.0330 C.3 36 ARG36 0.0995
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
557 550 C 9.4030 28.7700 3.3920 C.2 36 ARG36 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
558 551 O 10.3530 29.1310 4.0980 O.2 36 ARG36 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
559 552 CB 9.5300 26.9760 1.6020 C.3 36 ARG36 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
560 553 CG 11.0220 27.2130 1.3920 C.3 36 ARG36 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
561 554 CD 11.3170 26.9050 -0.0700 C.3 36 ARG36 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
562 555 NE 11.3270 28.1450 -0.8990 N.pl3 36 ARG36 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
563 556 CZ 10.6100 28.2980 -2.0240 C.cat 36 ARG36 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
564 557 NH1 10.7190 29.3670 -2.8200 N.pl3 36 ARG36 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
565 558 NH2 9.7230 27.3320 -2.3340 N.pl3 36 ARG36 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
566 559 H 7.1640 26.7050 2.2280 H 36 ARG36 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
567 560 HA 9.6190 26.6620 3.6840 H 36 ARG36 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
568 561 HB2 9.3280 25.9220 1.4110 H 36 ARG36 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
569 562 HB3 8.9890 27.5860 0.8780 H 36 ARG36 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
570 563 HG2 11.2620 28.2510 1.6240 H 36 ARG36 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
571 564 HG3 11.5910 26.5540 2.0480 H 36 ARG36 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
572 565 HD2 12.2940 26.4280 -0.1510 H 36 ARG36 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
573 566 HD3 10.5520 26.2350 -0.4620 H 36 ARG36 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
574 567 HE 11.9170 28.8960 -0.5700 H 36 ARG36 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
575 568 HH12 10.1560 29.4340 -3.6560 H 36 ARG36 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
576 569 HH11 11.3640 30.1080 -2.5850 H 36 ARG36 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
577 570 HH22 9.1640 27.4090 -3.1720 H 36 ARG36 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
578 571 HH21 9.6170 26.5310 -1.7290 H 36 ARG36 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
579 572 N 8.6550 29.6890 2.8210 N.am 37 MET37 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
580 573 CA 8.8030 31.1360 2.9710 C.3 37 MET37 0.1002
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
581 574 C 8.6180 31.5260 4.4510 C.2 37 MET37 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
582 575 O 9.4660 32.2440 5.0190 O.2 37 MET37 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
583 576 CB 8.0110 32.0000 2.0020 C.3 37 MET37 -0.0169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
584 577 CG 8.4300 31.6880 0.5700 C.3 37 MET37 -0.0044
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
585 578 SD 9.8960 32.7300 0.3290 S.3 37 MET37 -0.1641
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
586 579 CE 10.2880 32.7780 -1.3920 C.3 37 MET37 -0.0181
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
587 580 H 7.8950 29.4160 2.2140 H 37 MET37 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
588 581 HA 9.7100 31.4640 2.4630 H 37 MET37 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
589 582 HB2 6.9470 31.7950 2.1180 H 37 MET37 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
590 583 HB3 8.2030 33.0520 2.2120 H 37 MET37 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
591 584 HG2 8.6550 30.6250 0.4800 H 37 MET37 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
592 585 HG3 7.6190 31.9460 -0.1110 H 37 MET37 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
593 586 HE1 11.1680 33.4020 -1.5470 H 37 MET37 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
594 587 HE2 10.4920 31.7680 -1.7470 H 37 MET37 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
595 588 HE3 9.4460 33.1940 -1.9450 H 37 MET37 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
596 589 N 7.6170 31.0180 5.1000 N.am 38 THR38 -0.3003
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
597 590 CA 7.3170 31.3930 6.4640 C.3 38 THR38 0.1252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
598 591 C 8.1680 30.6490 7.5270 C.2 38 THR38 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
599 592 O 8.2360 31.2270 8.6290 O.2 38 THR38 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
600 593 CB 5.7720 31.3280 6.7660 C.3 38 THR38 0.0792
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
601 594 OG1 5.4620 29.9460 6.7100 O.3 38 THR38 -0.3897
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
602 595 CG2 5.0150 32.2860 5.8730 C.3 38 THR38 -0.0367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
603 596 H 7.0180 30.3380 4.6530 H 38 THR38 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
604 597 HA 7.3350 32.4790 6.5550 H 38 THR38 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
605 598 HB 5.5550 31.8910 7.6740 H 38 THR38 0.0614
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
606 599 HG1 4.5270 29.8200 6.8850 H 38 THR38 0.2099
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
607 600 HG21 3.9500 32.2270 6.0960 H 38 THR38 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
608 601 HG22 5.3670 33.3030 6.0490 H 38 THR38 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
609 602 HG23 5.1820 32.0200 4.8290 H 38 THR38 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
610 603 N 8.6800 29.5290 7.1330 N.am 39 THR39 -0.3003
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
611 604 CA 9.4440 28.7390 8.1370 C.3 39 THR39 0.1252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
612 605 C 10.9140 29.1000 8.1530 C.2 39 THR39 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
613 606 O 11.5670 29.1330 9.2170 O.2 39 THR39 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
614 607 CB 9.1990 27.2070 7.8660 C.3 39 THR39 0.0792
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
615 608 OG1 7.8020 26.8240 7.8660 O.3 39 THR39 -0.3897
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
616 609 CG2 9.9490 26.2940 8.8690 C.3 39 THR39 -0.0367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
617 610 H 8.5530 29.2240 6.1790 H 39 THR39 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
618 611 HA 8.9820 28.8530 9.1180 H 39 THR39 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
619 612 HB 9.6630 26.9260 6.9210 H 39 THR39 0.0614
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
620 613 HG1 7.7280 25.8820 7.6960 H 39 THR39 0.2099
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
621 614 HG21 9.7430 25.2500 8.6340 H 39 THR39 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
622 615 HG22 11.0210 26.4780 8.7970 H 39 THR39 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
623 616 HG23 9.6110 26.5110 9.8820 H 39 THR39 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
624 617 N 11.4830 29.3000 6.9780 N.am 40 THR40 -0.3003
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
625 618 CA 12.9240 29.5310 6.8460 C.3 40 THR40 0.1252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
626 619 C 13.4480 30.6890 7.6420 C.2 40 THR40 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
627 620 O 13.0670 31.8450 7.6680 O.2 40 THR40 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
628 621 CB 13.3210 29.6610 5.3160 C.3 40 THR40 0.0792
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
629 622 OG1 12.9430 28.4270 4.6780 O.3 40 THR40 -0.3897
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
630 623 CG2 14.8020 29.9460 5.1400 C.3 40 THR40 -0.0367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
631 624 H 10.9220 29.2960 6.1380 H 40 THR40 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
632 625 HA 13.4620 28.6110 7.0730 H 40 THR40 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
633 626 HB 12.8200 30.5270 4.8820 H 40 THR40 0.0614
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
634 627 HG1 13.1680 28.4660 3.7460 H 40 THR40 0.2099
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
635 628 HG21 15.0330 30.0280 4.0780 H 40 THR40 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
636 629 HG22 15.0540 30.8810 5.6390 H 40 THR40 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
637 630 HG23 15.3830 29.1340 5.5760 H 40 THR40 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
638 631 N 14.4810 30.3070 8.4170 N.am 41 SER41 -0.3005
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
639 632 CA 15.2380 31.2250 9.2820 C.3 41 SER41 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
640 633 C 16.6880 30.6890 9.2460 C.2 41 SER41 0.2363
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
641 634 O 16.8620 29.4280 9.3560 O.2 41 SER41 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
642 635 CB 14.7230 31.2510 10.7120 C.3 41 SER41 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
643 636 OG 15.4710 32.1990 11.4430 O.3 41 SER41 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
644 637 H 14.7760 29.3410 8.4260 H 41 SER41 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
645 638 HA 15.1720 32.2380 8.8840 H 41 SER41 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
646 639 HB2 13.6690 31.5290 10.7140 H 41 SER41 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
647 640 HB3 14.8390 30.2630 11.1580 H 41 SER41 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
648 641 HG 15.1560 32.2260 12.3490 H 41 SER41 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
649 642 N 17.6240 31.6060 9.0190 N.am 42 SER42 -0.3005
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
650 643 CA 19.0330 31.0800 8.9640 C.3 42 SER42 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
651 644 C 19.8820 31.6600 10.0930 C.2 42 SER42 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
652 645 O 21.1260 31.6320 10.1410 O.2 42 SER42 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
653 646 CB 19.6080 31.2420 7.5680 C.3 42 SER42 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
654 647 OG 20.1260 32.5540 7.4490 O.3 42 SER42 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
655 648 H 17.3640 32.5740 8.8980 H 42 SER42 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
656 649 HA 19.0130 29.9930 8.8910 H 42 SER42 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
657 650 HB2 20.4030 30.5120 7.4150 H 42 SER42 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
658 651 HB3 18.8220 31.0830 6.8300 H 42 SER42 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
659 652 HG 20.4940 32.6750 6.5710 H 42 SER42 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
660 653 N 19.1640 32.2070 11.0580 N.am 43 VAL43 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
661 654 CA 19.6690 32.8100 12.3020 C.3 43 VAL43 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
662 655 C 19.5030 31.6250 13.2590 C.2 43 VAL43 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
663 656 O 18.3990 31.0190 13.2830 O.2 43 VAL43 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
664 657 CB 18.8830 34.0730 12.6490 C.3 43 VAL43 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
665 658 CG1 19.4610 35.0520 13.6510 C.3 43 VAL43 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
666 659 CG2 18.5830 34.8410 11.3600 C.3 43 VAL43 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
667 660 H 18.1570 32.2400 10.9820 H 43 VAL43 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
668 661 HA 20.6840 33.1740 12.1440 H 43 VAL43 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
669 662 HB 17.8870 33.7980 12.9960 H 43 VAL43 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
670 663 HG11 18.7750 35.8890 13.7790 H 43 VAL43 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
671 664 HG12 19.6040 34.5510 14.6080 H 43 VAL43 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
672 665 HG13 20.4200 35.4210 13.2870 H 43 VAL43 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
673 666 HG21 18.0220 35.7450 11.5970 H 43 VAL43 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
674 667 HG22 19.5190 35.1130 10.8720 H 43 VAL43 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
675 668 HG23 17.9940 34.2130 10.6910 H 43 VAL43 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
676 669 N 20.6090 31.2950 13.9110 N.am 44 GLU44 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
677 670 CA 20.4740 30.1580 14.8620 C.3 44 GLU44 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
678 671 C 19.7800 30.8860 16.0260 C.2 44 GLU44 0.2338
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
679 672 O 19.9670 32.1180 16.1270 O.2 44 GLU44 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
680 673 CB 21.7180 29.4550 15.3540 C.3 44 GLU44 -0.0209
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
681 674 CG 21.5140 28.0170 15.8860 C.3 44 GLU44 -0.0111
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
682 675 CD 20.3490 27.3030 15.2500 C.2 44 GLU44 0.0418
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
683 676 OE1 19.7750 27.7440 14.2700 O.co2 44 GLU44 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
684 677 OE2 20.0170 26.2520 15.8450 O.co2 44 GLU44 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
685 678 H 21.4640 31.8060 13.7450 H 44 GLU44 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
686 679 HA 19.8680 29.3740 14.4080 H 44 GLU44 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
687 680 HB2 22.4390 29.3780 14.5400 H 44 GLU44 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
688 681 HB3 22.1570 30.0230 16.1740 H 44 GLU44 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
689 682 HG2 22.4080 27.4250 15.6880 H 44 GLU44 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
690 683 HG3 21.3310 28.0490 16.9600 H 44 GLU44 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
691 684 N 19.0270 30.1090 16.7490 N.am 45 GLY45 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
692 685 CA 18.2850 30.5700 17.9080 C.3 45 GLY45 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
693 686 C 16.9250 31.2280 17.7300 C.2 45 GLY45 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
694 687 O 16.2210 31.3340 18.7690 O.2 45 GLY45 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
695 688 H 18.9370 29.1310 16.5130 H 45 GLY45 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
696 689 HA2 18.0840 29.7280 18.5700 H 45 GLY45 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
697 690 HA3 18.8710 31.3190 18.4410 H 45 GLY45 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
698 691 N 16.6190 31.6700 16.5090 N.am 46 LYS46 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
699 692 CA 15.2960 32.3240 16.3370 C.3 46 LYS46 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
700 693 C 14.3740 31.4740 15.4730 C.2 46 LYS46 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
701 694 O 14.6900 30.4590 14.8440 O.2 46 LYS46 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
702 695 CB 15.4920 33.7270 15.8410 C.3 46 LYS46 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
703 696 CG 16.2980 34.6700 16.7360 C.3 46 LYS46 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
704 697 CD 16.7070 35.9320 16.0130 C.3 46 LYS46 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
705 698 CE 17.3290 36.9640 16.9340 C.3 46 LYS46 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
706 699 NZ 16.2080 37.6560 17.6550 N.4 46 LYS46 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
707 700 H 17.2760 31.5530 15.7500 H 46 LYS46 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
708 701 HA 14.8870 32.5810 17.3140 H 46 LYS46 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
709 702 HB2 16.0190 33.7050 14.8870 H 46 LYS46 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
710 703 HB3 14.5210 34.2050 15.7090 H 46 LYS46 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
711 704 HG2 15.6970 34.9550 17.6000 H 46 LYS46 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
712 705 HG3 17.2030 34.1660 17.0740 H 46 LYS46 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
713 706 HD2 17.4400 35.6890 15.2440 H 46 LYS46 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
714 707 HD3 15.8310 36.3860 15.5490 H 46 LYS46 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
715 708 HE2 17.9900 36.4670 17.6440 H 46 LYS46 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
716 709 HE3 17.9020 37.6790 16.3440 H 46 LYS46 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
717 710 HZ1 16.5880 38.3530 18.2800 H 46 LYS46 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
718 711 HZ2 15.6000 38.1020 16.9830 H 46 LYS46 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
719 712 HZ3 15.6810 36.9790 18.1880 H 46 LYS46 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
720 713 N 13.1150 31.8810 15.4990 N.am 47 GLN47 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
721 714 CA 12.0320 31.2420 14.7110 C.3 47 GLN47 0.0999
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
722 715 C 11.2750 32.4290 14.1560 C.2 47 GLN47 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
723 716 O 11.3950 33.5540 14.6590 O.2 47 GLN47 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
724 717 CB 11.0970 30.3320 15.5070 C.3 47 GLN47 -0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
725 718 CG 11.5280 28.9770 15.9290 C.3 47 GLN47 0.0259
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
726 719 CD 10.5150 27.9950 16.4410 C.2 47 GLN47 0.2106
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
727 720 OE1 9.3900 28.2900 16.7610 O.2 47 GLN47 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
728 721 NE2 10.8070 26.6730 16.4760 N.am 47 GLN47 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
729 722 H 12.8500 32.6660 16.0770 H 47 GLN47 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
730 723 HA 12.4690 30.6140 13.9350 H 47 GLN47 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
731 724 HB2 10.8300 30.8170 16.4460 H 47 GLN47 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
732 725 HB3 10.1940 30.1420 14.9270 H 47 GLN47 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
733 726 HG2 11.9910 28.4630 15.0860 H 47 GLN47 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
734 727 HG3 12.2480 29.0610 16.7430 H 47 GLN47 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
735 728 HE22 10.1240 26.0140 16.8210 H 47 GLN47 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
736 729 HE21 11.7080 26.3460 16.1570 H 47 GLN47 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
737 730 N 10.4940 32.2020 13.0750 N.am 48 ASN48 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
738 731 CA 9.7260 33.3290 12.5750 C.3 48 ASN48 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
739 732 C 8.4390 33.3940 13.4140 C.2 48 ASN48 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
740 733 O 7.9910 32.3710 13.9230 O.2 48 ASN48 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
741 734 CB 9.3770 33.0400 11.0780 C.3 48 ASN48 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
742 735 CG 10.6220 33.2730 10.2310 C.2 48 ASN48 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
743 736 OD1 11.5840 33.9600 10.6390 O.2 48 ASN48 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
744 737 ND2 10.6590 32.6890 9.0360 N.am 48 ASN48 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
745 738 H 10.4660 31.2830 12.6560 H 48 ASN48 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
746 739 HA 10.2950 34.2480 12.7160 H 48 ASN48 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
747 740 HB2 9.0480 32.0060 10.9740 H 48 ASN48 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
748 741 HB3 8.5800 33.7090 10.7550 H 48 ASN48 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
749 742 HD22 11.4630 32.8140 8.4380 H 48 ASN48 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
750 743 HD21 9.8830 32.1210 8.7270 H 48 ASN48 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
751 744 N 7.8200 34.5400 13.4380 N.am 49 LEU49 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
752 745 CA 6.5250 34.6400 14.1330 C.3 49 LEU49 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
753 746 C 5.4450 34.7400 12.9930 C.2 49 LEU49 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
754 747 O 5.6600 35.5530 12.0740 O.2 49 LEU49 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
755 748 CB 6.5850 35.8880 14.9970 C.3 49 LEU49 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
756 749 CG 5.2470 36.4050 15.5290 C.3 49 LEU49 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
757 750 CD1 4.7620 35.3580 16.5160 C.3 49 LEU49 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
758 751 CD2 5.4450 37.7740 16.1930 C.3 49 LEU49 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
759 752 H 8.2290 35.3440 12.9840 H 49 LEU49 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
760 753 HA 6.3750 33.7550 14.7520 H 49 LEU49 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
761 754 HB2 7.2030 35.6940 15.8740 H 49 LEU49 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
762 755 HB3 7.0170 36.7080 14.4230 H 49 LEU49 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
763 756 HG 4.5530 36.5410 14.6990 H 49 LEU49 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
764 757 HD11 3.8050 35.6690 16.9350 H 49 LEU49 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
765 758 HD12 4.6410 34.4030 16.0040 H 49 LEU49 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
766 759 HD13 5.4910 35.2490 17.3190 H 49 LEU49 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
767 760 HD21 4.4890 38.1370 16.5700 H 49 LEU49 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
768 761 HD22 6.1490 37.6790 17.0200 H 49 LEU49 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
769 762 HD23 5.8380 38.4800 15.4610 H 49 LEU49 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
770 763 N 4.4130 33.9230 13.0990 N.am 50 VAL50 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
771 764 CA 3.2950 34.0170 12.1000 C.3 50 VAL50 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
772 765 C 2.0760 34.5960 12.8770 C.2 50 VAL50 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
773 766 O 1.7140 34.0890 13.9480 O.2 50 VAL50 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
774 767 CB 2.9670 32.7260 11.3640 C.3 50 VAL50 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
775 768 CG1 4.2090 32.4020 10.4910 C.3 50 VAL50 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
776 769 CG2 2.6340 31.5120 12.2040 C.3 50 VAL50 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
777 770 H 4.3810 33.2440 13.8460 H 50 VAL50 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
778 771 HA 3.6260 34.5940 11.2370 H 50 VAL50 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
779 772 HB 2.0640 32.8650 10.7700 H 50 VAL50 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
780 773 HG11 4.0330 31.4810 9.9360 H 50 VAL50 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
781 774 HG12 4.3850 33.2190 9.7920 H 50 VAL50 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
782 775 HG13 5.0820 32.2780 11.1320 H 50 VAL50 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
783 776 HG21 2.4220 30.6650 11.5510 H 50 VAL50 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
784 777 HG22 3.4810 31.2710 12.8470 H 50 VAL50 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
785 778 HG23 1.7600 31.7240 12.8190 H 50 VAL50 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
786 779 N 1.5120 35.6000 12.3110 N.am 51 ILE51 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
787 780 CA 0.3700 36.3390 12.8280 C.3 51 ILE51 0.1020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
788 781 C -0.8270 36.0360 11.9450 C.2 51 ILE51 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
789 782 O -0.6640 36.2320 10.7180 O.2 51 ILE51 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
790 783 CB 0.6530 37.8940 12.9420 C.3 51 ILE51 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
791 784 CG1 1.7820 38.0870 13.9840 C.3 51 ILE51 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
792 785 CG2 -0.6850 38.6700 13.2230 C.3 51 ILE51 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
793 786 CD1 2.3160 39.5440 13.8670 C.3 51 ILE51 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
794 787 H 1.8590 35.9420 11.4260 H 51 ILE51 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
795 788 HA 0.2190 36.0870 13.8780 H 51 ILE51 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
796 789 HB 0.8350 38.3040 11.9490 H 51 ILE51 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
797 790 HG12 1.3870 37.9150 14.9850 H 51 ILE51 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
798 791 HG13 2.5860 37.3790 13.7850 H 51 ILE51 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
799 792 HG21 -0.4770 39.7370 13.2990 H 51 ILE51 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
800 793 HG22 -1.3860 38.4940 12.4070 H 51 ILE51 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
801 794 HG23 -1.1210 38.3170 14.1580 H 51 ILE51 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
802 795 HD11 3.1130 39.6990 14.5940 H 51 ILE51 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
803 796 HD12 2.7050 39.7100 12.8620 H 51 ILE51 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
804 797 HD13 1.5050 40.2460 14.0630 H 51 ILE51 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
805 798 N -1.9240 35.6520 12.6170 N.am 52 MET52 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
806 799 CA -3.1310 35.4150 11.7930 C.3 52 MET52 0.1001
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
807 800 C -4.4130 35.7580 12.5700 C.2 52 MET52 0.2338
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
808 801 O -4.3460 35.5330 13.7750 O.2 52 MET52 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
809 802 CB -3.2400 33.9860 11.4410 C.3 52 MET52 -0.0169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
810 803 CG -3.3130 33.0380 12.5430 C.3 52 MET52 -0.0044
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
811 804 SD -2.8930 31.4970 11.6310 S.3 52 MET52 -0.1641
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
812 805 CE -1.2430 31.2040 12.1600 C.3 52 MET52 -0.0181
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
813 806 H -1.8890 35.5430 13.6200 H 52 MET52 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
814 807 HA -3.1130 36.0720 10.9240 H 52 MET52 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
815 808 HB2 -4.1450 33.8240 10.8550 H 52 MET52 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
816 809 HB3 -2.3700 33.6880 10.8560 H 52 MET52 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
817 810 HG2 -2.5910 33.3170 13.3110 H 52 MET52 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
818 811 HG3 -4.3170 33.0500 12.9670 H 52 MET52 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
819 812 HE1 -0.8640 30.3000 11.6840 H 52 MET52 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
820 813 HE2 -0.6160 32.0510 11.8820 H 52 MET52 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
821 814 HE3 -1.2250 31.0790 13.2430 H 52 MET52 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
822 815 N -5.4020 36.1820 11.8220 N.am 53 GLY53 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
823 816 CA -6.7050 36.5030 12.4600 C.3 53 GLY53 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
824 817 C -7.3700 35.1660 12.7590 C.2 53 GLY53 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
825 818 O -6.9620 34.0570 12.4000 O.2 53 GLY53 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
826 819 H -5.2730 36.2870 10.8260 H 53 GLY53 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
827 820 HA2 -6.5320 37.0690 13.3750 H 53 GLY53 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
828 821 HA3 -7.3090 37.0970 11.7750 H 53 GLY53 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
829 822 N -8.5020 35.3040 13.4270 N.am 54 LYS54 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
830 823 CA -9.2890 34.1150 13.8570 C.3 54 LYS54 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
831 824 C -9.7840 33.2650 12.6990 C.2 54 LYS54 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
832 825 O -9.6210 32.0300 12.8060 O.2 54 LYS54 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
833 826 CB -10.4720 34.6100 14.7050 C.3 54 LYS54 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
834 827 CG -11.3120 33.5150 15.3360 C.3 54 LYS54 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
835 828 CD -12.6980 34.1490 15.5860 C.3 54 LYS54 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
836 829 CE -13.5650 34.1050 14.3440 C.3 54 LYS54 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
837 830 NZ -13.9290 32.6970 13.9280 N.4 54 LYS54 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
838 831 H -8.8460 36.2260 13.6530 H 54 LYS54 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
839 832 HA -8.6860 33.5030 14.5280 H 54 LYS54 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
840 833 HB2 -10.1000 35.2280 15.5220 H 54 LYS54 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
841 834 HB3 -11.1450 35.1990 14.0820 H 54 LYS54 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
842 835 HG2 -11.3790 32.6690 14.6520 H 54 LYS54 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
843 836 HG3 -10.8480 33.1920 16.2680 H 54 LYS54 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
844 837 HD2 -13.2090 33.6050 16.3810 H 54 LYS54 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
845 838 HD3 -12.5740 35.1910 15.8810 H 54 LYS54 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
846 839 HE2 -14.4930 34.6460 14.5290 H 54 LYS54 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
847 840 HE3 -13.0340 34.5690 13.5130 H 54 LYS54 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
848 841 HZ1 -14.5050 32.7290 13.0990 H 54 LYS54 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
849 842 HZ2 -13.0870 32.1750 13.7330 H 54 LYS54 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
850 843 HZ3 -14.4390 32.2460 14.6740 H 54 LYS54 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
851 844 N -10.3300 33.9190 11.6460 N.am 55 LYS55 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
852 845 CA -10.8450 33.1990 10.4860 C.3 55 LYS55 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
853 846 C -9.7320 32.4080 9.8350 C.2 55 LYS55 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
854 847 O -9.9430 31.2300 9.5620 O.2 55 LYS55 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
855 848 CB -11.6230 34.1030 9.5240 C.3 55 LYS55 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
856 849 CG -12.9580 34.4260 10.1970 C.3 55 LYS55 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
857 850 CD -13.9890 34.9700 9.2010 C.3 55 LYS55 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
858 851 CE -13.3790 36.1110 8.4150 C.3 55 LYS55 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
859 852 NZ -14.5170 37.0080 7.9800 N.4 55 LYS55 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
860 853 H -10.3870 34.9270 11.6520 H 55 LYS55 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
861 854 HA -11.7330 32.6360 10.7720 H 55 LYS55 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
862 855 HB2 -11.0540 35.0140 9.3400 H 55 LYS55 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
863 856 HB3 -11.7830 33.5790 8.5820 H 55 LYS55 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
864 857 HG2 -13.3660 33.5220 10.6480 H 55 LYS55 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
865 858 HG3 -12.8030 35.1790 10.9700 H 55 LYS55 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
866 859 HD2 -14.2870 34.1760 8.5160 H 55 LYS55 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
867 860 HD3 -14.8640 35.3290 9.7430 H 55 LYS55 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
868 861 HE2 -12.6800 36.6570 9.0490 H 55 LYS55 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
869 862 HE3 -12.8500 35.7140 7.5490 H 55 LYS55 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
870 863 HZ1 -14.1500 37.7850 7.4500 H 55 LYS55 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
871 864 HZ2 -15.1600 36.4820 7.4050 H 55 LYS55 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
872 865 HZ3 -15.0020 37.3560 8.7950 H 55 LYS55 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
873 866 N -8.5570 33.0360 9.6970 N.am 56 THR56 -0.3003
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
874 867 CA -7.4350 32.2840 9.0690 C.3 56 THR56 0.1252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
875 868 C -7.0230 31.0610 9.8870 C.2 56 THR56 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
876 869 O -6.8110 29.9570 9.2940 O.2 56 THR56 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
877 870 CB -6.2480 33.2740 8.7430 C.3 56 THR56 0.0792
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
878 871 OG1 -6.8410 34.3580 7.9910 O.3 56 THR56 -0.3897
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
879 872 CG2 -5.0980 32.5420 8.0280 C.3 56 THR56 -0.0367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
880 873 H -8.4540 33.9890 10.0140 H 56 THR56 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
881 874 HA -7.6800 32.0660 8.0290 H 56 THR56 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
882 875 HB -5.7480 33.5600 9.6680 H 56 THR56 0.0614
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
883 876 HG1 -6.1630 34.9980 7.7620 H 56 THR56 0.2099
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
884 877 HG21 -4.2940 33.2470 7.8150 H 56 THR56 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
885 878 HG22 -4.7210 31.7440 8.6680 H 56 THR56 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
886 879 HG23 -5.4630 32.1160 7.0940 H 56 THR56 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
887 880 N -6.8550 31.3050 11.1740 N.am 57 TRP57 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
888 881 CA -6.4600 30.1860 12.0600 C.3 57 TRP57 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
889 882 C -7.3490 28.9530 11.8680 C.2 57 TRP57 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
890 883 O -6.9350 27.8090 11.7060 O.2 57 TRP57 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
891 884 CB -6.4860 30.6750 13.5010 C.3 57 TRP57 0.0013
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
892 885 CG -6.2660 29.7030 14.6010 C.ar 57 TRP57 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
893 886 CD1 -7.2290 29.1750 15.4370 C.ar 57 TRP57 0.0060
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
894 887 CD2 -5.0060 29.1080 14.9910 C.ar 57 TRP57 0.0029
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
895 888 NE1 -6.6120 28.2560 16.2720 N.ar 57 TRP57 -0.3604
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
896 889 CE2 -5.2780 28.2220 16.0540 C.ar 57 TRP57 0.0467
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
897 890 CE3 -3.6930 29.2340 14.5500 C.ar 57 TRP57 -0.0523
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
898 891 CZ2 -4.2940 27.4750 16.6880 C.ar 57 TRP57 -0.0378
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
899 892 CZ3 -2.6850 28.4850 15.1770 C.ar 57 TRP57 -0.0611
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
900 893 CH2 -2.9840 27.6170 16.2100 C.ar 57 TRP57 -0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
901 894 H -6.9960 32.2380 11.5340 H 57 TRP57 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
902 895 HA -5.4110 29.9420 11.8920 H 57 TRP57 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
903 896 HB2 -5.7090 31.4260 13.6440 H 57 TRP57 0.0337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
904 897 HB3 -7.4600 31.1140 13.7190 H 57 TRP57 0.0337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
905 898 HD1 -8.2540 29.5040 15.3550 H 57 TRP57 0.0810
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
906 899 HE1 -7.1620 27.7220 16.9300 H 57 TRP57 0.1653
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
907 900 HE3 -3.4590 29.9020 13.7340 H 57 TRP57 0.0624
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
908 901 HZ2 -4.5550 26.8230 17.5090 H 57 TRP57 0.0638
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
909 902 HZ3 -1.6590 28.5830 14.8540 H 57 TRP57 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
910 903 HH2 -2.1830 27.0410 16.6500 H 57 TRP57 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
911 904 N -8.6550 29.1580 12.0070 N.am 58 PHE58 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
912 905 CA -9.6410 28.0900 11.9040 C.3 58 PHE58 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
913 906 C -9.7580 27.5570 10.4960 C.2 58 PHE58 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
914 907 O -10.2510 26.4020 10.3460 O.2 58 PHE58 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
915 908 CB -10.9710 28.4260 12.5910 C.3 58 PHE58 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
916 909 CG -10.9630 28.6520 14.0760 C.ar 58 PHE58 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
917 910 CD1 -11.4220 29.8690 14.5660 C.ar 58 PHE58 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
918 911 CD2 -10.5570 27.6010 14.9090 C.ar 58 PHE58 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
919 912 CE1 -11.4260 30.1020 15.9510 C.ar 58 PHE58 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
920 913 CE2 -10.5700 27.8070 16.3030 C.ar 58 PHE58 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
921 914 CZ -11.0030 29.0640 16.7780 C.ar 58 PHE58 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
922 915 H -9.0030 30.0880 12.1930 H 58 PHE58 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
923 916 HA -9.4830 27.3700 12.7070 H 58 PHE58 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
924 917 HB2 -11.3770 29.3450 12.1680 H 58 PHE58 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
925 918 HB3 -11.6780 27.6110 12.4340 H 58 PHE58 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
926 919 HD1 -11.7730 30.6280 13.8830 H 58 PHE58 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
927 920 HD2 -10.2440 26.6610 14.4790 H 58 PHE58 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
928 921 HE1 -11.7490 31.0580 16.3370 H 58 PHE58 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
929 922 HE2 -10.2550 27.0170 16.9690 H 58 PHE58 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
930 923 HZ -10.9940 29.1970 17.8500 H 58 PHE58 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
931 924 N -9.3340 28.2560 9.4730 N.am 59 SER59 -0.3006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
932 925 CA -9.3420 27.7380 8.0940 C.3 59 SER59 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
933 926 C -8.2330 26.7030 7.8920 C.2 59 SER59 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
934 927 O -8.2670 25.8930 6.9440 O.2 59 SER59 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
935 928 CB -8.8950 28.8690 7.0960 C.3 59 SER59 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
936 929 OG -10.1590 29.5470 7.0070 O.3 59 SER59 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
937 930 H -8.9820 29.1920 9.6120 H 59 SER59 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
938 931 HA -10.2350 27.1330 7.9380 H 59 SER59 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
939 932 HB2 -8.0880 29.4500 7.5430 H 59 SER59 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
940 933 HB3 -8.5460 28.4180 6.1670 H 59 SER59 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
941 934 HG -10.0780 30.2990 6.4160 H 59 SER59 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
942 935 N -7.2200 26.7810 8.7240 N.am 60 ILE60 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
943 936 CA -6.1080 25.8240 8.6660 C.3 60 ILE60 0.1022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
944 937 C -6.6260 24.5110 9.2990 C.2 60 ILE60 0.2368
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
945 938 O -7.0670 24.5280 10.4610 O.2 60 ILE60 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
946 939 CB -4.7780 26.2870 9.3400 C.3 60 ILE60 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
947 940 CG1 -4.2700 27.6200 8.7690 C.3 60 ILE60 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
948 941 CG2 -3.6790 25.1600 9.1720 C.3 60 ILE60 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
949 942 CD1 -3.3230 28.5610 9.5420 C.3 60 ILE60 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
950 943 H -7.1950 27.5100 9.4220 H 60 ILE60 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
951 944 HA -5.7690 25.7220 7.6350 H 60 ILE60 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
952 945 HB -4.9240 26.3660 10.4170 H 60 ILE60 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
953 946 HG12 -3.7130 27.4340 7.8510 H 60 ILE60 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
954 947 HG13 -5.1180 28.2700 8.5540 H 60 ILE60 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
955 948 HG21 -2.7510 25.4840 9.6430 H 60 ILE60 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
956 949 HG22 -4.0250 24.2410 9.6460 H 60 ILE60 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
957 950 HG23 -3.5040 24.9780 8.1120 H 60 ILE60 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
958 951 HD11 -3.1050 29.4380 8.9330 H 60 ILE60 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
959 952 HD12 -3.7990 28.8730 10.4710 H 60 ILE60 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
960 953 HD13 -2.3940 28.0370 9.7690 H 60 ILE60 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
961 954 N -6.5130 23.3800 8.6260 N.am 61 PRO61 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
962 955 CA -6.9170 22.0840 9.1680 C.3 61 PRO61 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
963 956 C -6.1640 21.8080 10.4550 C.2 61 PRO61 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
964 957 O -4.9380 22.0230 10.5910 O.2 61 PRO61 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
965 958 CB -6.5850 21.0440 8.0990 C.3 61 PRO61 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
966 959 CG -6.3720 21.8400 6.8300 C.3 61 PRO61 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
967 960 CD -5.9820 23.2520 7.2490 C.3 61 PRO61 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
968 961 HA -7.9890 22.0900 9.3630 H 61 PRO61 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
969 962 HB2 -5.6860 20.5000 8.3880 H 61 PRO61 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
970 963 HB3 -7.4160 20.3450 8.0000 H 61 PRO61 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
971 964 HG2 -5.5780 21.3800 6.2410 H 61 PRO61 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
972 965 HG3 -7.2940 21.8520 6.2490 H 61 PRO61 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
973 966 HD3 -6.4380 24.0090 6.6110 H 61 PRO61 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
974 967 HD2 -4.9010 23.3920 7.2610 H 61 PRO61 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
975 968 N -6.9570 21.2740 11.4050 N.am 62 GLU62 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
976 969 CA -6.4140 20.9360 12.7350 C.3 62 GLU62 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
977 970 C -5.1530 20.1170 12.6980 C.2 62 GLU62 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
978 971 O -4.2360 20.3950 13.5300 O.2 62 GLU62 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
979 972 CB -7.5270 20.3560 13.6450 C.3 62 GLU62 -0.0209
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
980 973 CG -7.4590 20.9020 15.0540 C.3 62 GLU62 -0.0111
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
981 974 CD -8.5890 20.7540 16.0290 C.2 62 GLU62 0.0418
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
982 975 OE1 -9.7220 21.1650 15.8570 O.co2 62 GLU62 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
983 976 OE2 -8.1720 20.2000 17.0890 O.co2 62 GLU62 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
984 977 H -7.9330 21.1020 11.2100 H 62 GLU62 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
985 978 HA -6.3610 21.8370 13.3460 H 62 GLU62 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
986 979 HB2 -8.5030 20.6090 13.2320 H 62 GLU62 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
987 980 HB3 -7.4260 19.2720 13.6980 H 62 GLU62 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
988 981 HG2 -6.6250 20.4410 15.5830 H 62 GLU62 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
989 982 HG3 -7.3140 21.9820 15.0190 H 62 GLU62 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
990 983 N -4.9910 19.2870 11.7220 N.am 63 LYS63 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
991 984 CA -3.7580 18.4680 11.5530 C.3 63 LYS63 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
992 985 C -2.5310 19.3160 11.2420 C.2 63 LYS63 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
993 986 O -1.3630 18.9340 11.4740 O.2 63 LYS63 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
994 987 CB -3.9570 17.3270 10.5710 C.3 63 LYS63 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
995 988 CG -4.5340 17.5830 9.2120 C.3 63 LYS63 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
996 989 CD -3.5290 17.9190 8.1310 C.3 63 LYS63 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
997 990 CE -4.1430 17.5740 6.7660 C.3 63 LYS63 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
998 991 NZ -5.6240 17.8580 6.7810 N.4 63 LYS63 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
999 992 H -5.7190 19.1720 11.0310 H 63 LYS63 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1000 993 HA -3.6460 17.7990 12.4060 H 63 LYS63 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1001 994 HB2 -2.9960 16.8580 10.3580 H 63 LYS63 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1002 995 HB3 -4.6330 16.5890 11.0030 H 63 LYS63 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1003 996 HG2 -5.0680 16.6960 8.8700 H 63 LYS63 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1004 997 HG3 -5.2240 18.4250 9.2630 H 63 LYS63 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1005 998 HD2 -3.2920 18.9820 8.1730 H 63 LYS63 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1006 999 HD3 -2.6200 17.3380 8.2860 H 63 LYS63 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1007 1000 HE2 -3.6700 18.1770 5.9910 H 63 LYS63 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1008 1001 HE3 -3.9830 16.5170 6.5510 H 63 LYS63 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1009 1002 HZ1 -6.0200 17.6290 5.8810 H 63 LYS63 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1010 1003 HZ2 -6.0670 17.2990 7.4960 H 63 LYS63 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1011 1004 HZ3 -5.7780 18.8370 6.9770 H 63 LYS63 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1012 1005 N -2.7300 20.5520 10.8180 N.am 64 ASN64 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1013 1006 CA -1.6300 21.4510 10.4690 C.3 64 ASN64 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1014 1007 C -1.4550 22.6780 11.3430 C.2 64 ASN64 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1015 1008 O -0.7960 23.6420 10.9070 O.2 64 ASN64 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1016 1009 CB -1.8800 21.9640 9.0650 C.3 64 ASN64 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1017 1010 CG -1.9070 21.2510 7.7780 C.2 64 ASN64 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1018 1011 OD1 -2.8730 20.6470 7.2590 O.2 64 ASN64 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1019 1012 ND2 -0.7250 21.3950 7.1350 N.am 64 ASN64 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1020 1013 H -3.6700 20.9090 10.7240 H 64 ASN64 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1021 1014 HA -0.6840 20.9130 10.5390 H 64 ASN64 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1022 1015 HB2 -2.8710 22.4140 9.0130 H 64 ASN64 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1023 1016 HB3 -1.1280 22.7120 8.8120 H 64 ASN64 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1024 1017 HD22 -0.5850 20.9620 6.2330 H 64 ASN64 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1025 1018 HD21 0.0170 21.9350 7.5570 H 64 ASN64 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1026 1019 N -2.0650 22.7100 12.4820 N.am 65 ARG65 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1027 1020 CA -2.0460 23.7670 13.4690 C.3 65 ARG65 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1028 1021 C -1.5230 23.1980 14.7900 C.2 65 ARG65 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1029 1022 O -2.0450 22.1310 15.1620 O.2 65 ARG65 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1030 1023 CB -3.4780 24.2000 13.8070 C.3 65 ARG65 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1031 1024 CG -3.9960 25.3700 13.0420 C.3 65 ARG65 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1032 1025 CD -5.3090 25.8270 13.6250 C.3 65 ARG65 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1033 1026 NE -6.4370 25.1530 12.9940 N.pl3 65 ARG65 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1034 1027 CZ -7.3970 24.7060 13.7690 C.cat 65 ARG65 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1035 1028 NH1 -7.1510 24.7740 15.0610 N.pl3 65 ARG65 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1036 1029 NH2 -8.5470 24.2670 13.2670 N.pl3 65 ARG65 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1037 1030 H -2.6380 21.9300 12.7700 H 65 ARG65 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1038 1031 HA -1.2980 24.5100 13.1920 H 65 ARG65 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1039 1032 HB2 -4.1640 23.3770 13.6080 H 65 ARG65 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1040 1033 HB3 -3.5360 24.4740 14.8600 H 65 ARG65 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1041 1034 HG2 -3.2770 26.1870 13.0950 H 65 ARG65 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1042 1035 HG3 -4.1460 25.0860 12.0000 H 65 ARG65 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1043 1036 HD2 -5.3290 25.6070 14.6920 H 65 ARG65 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1044 1037 HD3 -5.4200 26.9010 13.4730 H 65 ARG65 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1045 1038 HE -6.4950 25.0250 11.9940 H 65 ARG65 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1046 1039 HH12 -7.8400 24.4500 15.7240 H 65 ARG65 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1047 1040 HH11 -6.2730 25.1500 15.3890 H 65 ARG65 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1048 1041 HH22 -9.2710 23.9280 13.8840 H 65 ARG65 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1049 1042 HH21 -8.6970 24.2730 12.2680 H 65 ARG65 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1050 1043 N -0.6200 23.8550 15.4510 N.am 66 PRO66 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1051 1044 CA 0.0140 25.1070 15.0310 C.3 66 PRO66 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1052 1045 C 0.9770 24.7350 13.9000 C.2 66 PRO66 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1053 1046 O 1.3700 23.5630 13.6000 O.2 66 PRO66 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1054 1047 CB 0.6580 25.6080 16.3090 C.3 66 PRO66 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1055 1048 CG 1.0540 24.3550 17.0470 C.3 66 PRO66 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1056 1049 CD -0.0290 23.3260 16.6950 C.3 66 PRO66 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1057 1050 HA -0.7530 25.8160 14.7190 H 66 PRO66 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1058 1051 HB2 1.5220 26.2250 16.0630 H 66 PRO66 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1059 1052 HB3 -0.0630 26.2010 16.8720 H 66 PRO66 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1060 1053 HG2 2.0390 24.0310 16.7120 H 66 PRO66 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1061 1054 HG3 1.0830 24.5570 18.1180 H 66 PRO66 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1062 1055 HD3 -0.7990 23.2570 17.4630 H 66 PRO66 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1063 1056 HD2 0.3870 22.3360 16.5080 H 66 PRO66 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1064 1057 N 1.3440 25.8050 13.2120 N.am 67 LEU67 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1065 1058 CA 2.2370 25.7050 12.0450 C.3 67 LEU67 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1066 1059 C 3.6200 25.3790 12.6510 C.2 67 LEU67 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1067 1060 O 4.1670 26.2130 13.3810 O.2 67 LEU67 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1068 1061 CB 2.1620 27.0230 11.2710 C.3 67 LEU67 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1069 1062 CG 0.8340 27.3790 10.5570 C.3 67 LEU67 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1070 1063 CD1 0.9490 28.7990 10.0000 C.3 67 LEU67 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1071 1064 CD2 0.6430 26.4270 9.4060 C.3 67 LEU67 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1072 1065 H 1.0100 26.7190 13.4840 H 67 LEU67 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1073 1066 HA 1.8550 24.9500 11.3580 H 67 LEU67 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1074 1067 HB2 2.3470 27.8550 11.9500 H 67 LEU67 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1075 1068 HB3 2.9140 27.0250 10.4820 H 67 LEU67 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1076 1069 HG 0.0180 27.3650 11.2790 H 67 LEU67 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1077 1070 HD11 0.0220 29.0670 9.4930 H 67 LEU67 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1078 1071 HD12 1.1310 29.4970 10.8170 H 67 LEU67 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1079 1072 HD13 1.7760 28.8460 9.2920 H 67 LEU67 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1080 1073 HD21 -0.2880 26.6620 8.8900 H 67 LEU67 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1081 1074 HD22 1.4770 26.5240 8.7110 H 67 LEU67 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1082 1075 HD23 0.6010 25.4050 9.7820 H 67 LEU67 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1083 1076 N 4.1180 24.1950 12.3490 N.am 68 LYS68 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1084 1077 CA 5.3930 23.7360 12.9360 C.3 68 LYS68 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1085 1078 C 6.5650 24.6360 12.6510 C.2 68 LYS68 0.2337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1086 1079 O 6.6920 25.2280 11.5640 O.2 68 LYS68 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1087 1080 CB 5.7550 22.3410 12.4080 C.3 68 LYS68 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1088 1081 CG 4.6590 21.3070 12.5910 C.3 68 LYS68 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1089 1082 CD 4.9470 20.0490 11.7530 C.3 68 LYS68 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1090 1083 CE 4.1700 20.0380 10.4370 C.3 68 LYS68 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1091 1084 NZ 3.9510 18.6440 9.9400 N.4 68 LYS68 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1092 1085 H 3.6260 23.5890 11.7080 H 68 LYS68 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1093 1086 HA 5.2890 23.6610 14.0180 H 68 LYS68 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1094 1087 HB2 5.9660 22.4000 11.3400 H 68 LYS68 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1095 1088 HB3 6.6360 21.9710 12.9320 H 68 LYS68 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1096 1089 HG2 4.5990 21.0220 13.6410 H 68 LYS68 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1097 1090 HG3 3.7050 21.7280 12.2740 H 68 LYS68 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1098 1091 HD2 6.0100 20.0040 11.5170 H 68 LYS68 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1099 1092 HD3 4.6640 19.1620 12.3190 H 68 LYS68 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1100 1093 HE2 3.1970 20.5080 10.5850 H 68 LYS68 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1101 1094 HE3 4.7280 20.5900 9.6800 H 68 LYS68 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1102 1095 HZ1 3.4360 18.6730 9.0710 H 68 LYS68 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1103 1096 HZ2 4.8430 18.1960 9.7870 H 68 LYS68 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1104 1097 HZ3 3.4250 18.1200 10.6250 H 68 LYS68 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1105 1098 N 7.5060 24.6820 13.5900 N.am 69 GLY69 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1106 1099 CA 8.7430 25.4760 13.4400 C.3 69 GLY69 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1107 1100 C 8.5680 26.9800 13.4190 C.2 69 GLY69 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1108 1101 O 9.4870 27.7250 12.9880 O.2 69 GLY69 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1109 1102 H 7.3900 24.1610 14.4470 H 69 GLY69 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1110 1103 HA2 9.4160 25.2620 14.2700 H 69 GLY69 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1111 1104 HA3 9.2310 25.2150 12.5010 H 69 GLY69 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1112 1105 N 7.4060 27.4740 13.7510 N.am 70 ARG70 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1113 1106 CA 7.0710 28.9100 13.7980 C.3 70 ARG70 0.0995
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1114 1107 C 6.2860 29.2240 15.0950 C.2 70 ARG70 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1115 1108 O 5.5780 28.3560 15.6480 O.2 70 ARG70 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1116 1109 CB 6.1550 29.2870 12.5990 C.3 70 ARG70 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1117 1110 CG 6.9300 29.3880 11.3070 C.3 70 ARG70 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1118 1111 CD 6.0930 29.0010 10.1250 C.3 70 ARG70 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1119 1112 NE 5.8120 27.5550 10.1210 N.pl3 70 ARG70 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1120 1113 CZ 5.1110 26.9110 9.2020 C.cat 70 ARG70 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1121 1114 NH1 4.5920 27.4670 8.0770 N.pl3 70 ARG70 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1122 1115 NH2 4.9420 25.5990 9.3430 N.pl3 70 ARG70 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1123 1116 H 6.6480 26.8560 14.0030 H 70 ARG70 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1124 1117 HA 7.9890 29.4970 13.8160 H 70 ARG70 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1125 1118 HB2 5.3850 28.5250 12.4760 H 70 ARG70 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1126 1119 HB3 5.6840 30.2510 12.7900 H 70 ARG70 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1127 1120 HG2 7.2690 30.4140 11.1650 H 70 ARG70 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1128 1121 HG3 7.7930 28.7230 11.3470 H 70 ARG70 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1129 1122 HD2 5.1450 29.5390 10.1580 H 70 ARG70 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1130 1123 HD3 6.6220 29.2540 9.2060 H 70 ARG70 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1131 1124 HE 6.2050 27.0500 10.9020 H 70 ARG70 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1132 1125 HH12 4.0680 26.8980 7.4280 H 70 ARG70 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1133 1126 HH11 4.7300 28.4500 7.8890 H 70 ARG70 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1134 1127 HH22 4.4110 25.0820 8.6570 H 70 ARG70 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1135 1128 HH21 5.3440 25.1200 10.1360 H 70 ARG70 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1136 1129 N 6.4120 30.4310 15.5860 N.am 71 ILE71 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1137 1130 CA 5.6610 30.9050 16.7790 C.3 71 ILE71 0.1020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1138 1131 C 4.3010 31.3720 16.2050 C.2 71 ILE71 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1139 1132 O 4.2760 32.2520 15.3290 O.2 71 ILE71 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1140 1133 CB 6.3630 32.0550 17.5500 C.3 71 ILE71 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1141 1134 CG1 7.7390 31.5180 18.0860 C.3 71 ILE71 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1142 1135 CG2 5.4840 32.7040 18.6650 C.3 71 ILE71 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1143 1136 CD1 8.6030 32.7510 18.4590 C.3 71 ILE71 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1144 1137 H 7.0430 31.0900 15.1520 H 71 ILE71 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1145 1138 HA 5.5620 30.0890 17.4950 H 71 ILE71 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1146 1139 HB 6.4180 32.9390 16.9140 H 71 ILE71 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1147 1140 HG12 7.5690 30.8920 18.9620 H 71 ILE71 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1148 1141 HG13 8.2280 30.9300 17.3090 H 71 ILE71 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1149 1142 HG21 6.0470 33.4980 19.1560 H 71 ILE71 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1150 1143 HG22 4.5810 33.1210 18.2200 H 71 ILE71 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1151 1144 HG23 5.2100 31.9460 19.3990 H 71 ILE71 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1152 1145 HD11 9.5700 32.4170 18.8370 H 71 ILE71 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1153 1146 HD12 8.7530 33.3710 17.5750 H 71 ILE71 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1154 1147 HD13 8.0940 33.3330 19.2280 H 71 ILE71 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1155 1148 N 3.2420 30.7760 16.7420 N.am 72 ASN72 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1156 1149 CA 1.8810 31.1270 16.2120 C.3 72 ASN72 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1157 1150 C 1.1330 32.1230 17.0910 C.2 72 ASN72 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1158 1151 O 0.9210 31.8420 18.3100 O.2 72 ASN72 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1159 1152 CB 1.0640 29.8190 16.0940 C.3 72 ASN72 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1160 1153 CG 1.5530 28.8730 15.0010 C.2 72 ASN72 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1161 1154 OD1 0.7490 28.4680 14.1390 O.2 72 ASN72 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1162 1155 ND2 2.8050 28.4500 15.0800 N.am 72 ASN72 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1163 1156 H 3.3640 30.1060 17.4870 H 72 ASN72 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1164 1157 HA 1.9770 31.5450 15.2100 H 72 ASN72 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1165 1158 HB2 1.1140 29.2720 17.0360 H 72 ASN72 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1166 1159 HB3 0.0250 30.0580 15.8680 H 72 ASN72 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1167 1160 HD22 3.1710 27.8230 14.3780 H 72 ASN72 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1168 1161 HD21 3.3940 28.7550 15.8420 H 72 ASN72 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1169 1162 N 0.7240 33.2400 16.5570 N.am 73 LEU73 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1170 1163 CA 0.0170 34.2670 17.3130 C.3 73 LEU73 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1171 1164 C -1.3020 34.5960 16.5850 C.2 73 LEU73 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1172 1165 O -1.3120 34.9310 15.3840 O.2 73 LEU73 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1173 1166 CB 0.9100 35.4930 17.4900 C.3 73 LEU73 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1174 1167 CG 0.2740 36.7030 18.2290 C.3 73 LEU73 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1175 1168 CD1 1.4660 37.5840 18.6670 C.3 73 LEU73 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1176 1169 CD2 -0.6110 37.6250 17.3960 C.3 73 LEU73 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1177 1170 H 0.8930 33.4240 15.5780 H 73 LEU73 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1178 1171 HA -0.1390 33.9230 18.3360 H 73 LEU73 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1179 1172 HB2 1.7940 35.2190 18.0660 H 73 LEU73 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1180 1173 HB3 1.2160 35.8650 16.5120 H 73 LEU73 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1181 1174 HG -0.2340 36.3540 19.1280 H 73 LEU73 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1182 1175 HD11 1.0950 38.4610 19.1970 H 73 LEU73 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1183 1176 HD12 2.1190 37.0110 19.3260 H 73 LEU73 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1184 1177 HD13 2.0260 37.9020 17.7880 H 73 LEU73 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1185 1178 HD21 -0.9940 38.4280 18.0250 H 73 LEU73 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1186 1179 HD22 -0.0270 38.0500 16.5800 H 73 LEU73 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1187 1180 HD23 -1.4460 37.0560 16.9870 H 73 LEU73 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1188 1181 N -2.3850 34.4680 17.3820 N.am 74 VAL74 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1189 1182 CA -3.7310 34.7750 16.7730 C.3 74 VAL74 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1190 1183 C -4.0920 36.1880 17.1900 C.2 74 VAL74 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1191 1184 O -3.9420 36.6000 18.3810 O.2 74 VAL74 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1192 1185 CB -4.7450 33.6990 17.2330 C.3 74 VAL74 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1193 1186 CG1 -6.1650 34.0240 16.7310 C.3 74 VAL74 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1194 1187 CG2 -4.3250 32.3510 16.6790 C.3 74 VAL74 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1195 1188 H -2.2730 34.1770 18.3430 H 74 VAL74 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1196 1189 HA -3.6830 34.6320 15.6930 H 74 VAL74 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1197 1190 HB -4.7610 33.6560 18.3220 H 74 VAL74 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1198 1191 HG11 -6.8560 33.2520 17.0690 H 74 VAL74 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1199 1192 HG12 -6.4790 34.9900 17.1270 H 74 VAL74 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1200 1193 HG13 -6.1660 34.0610 15.6420 H 74 VAL74 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1201 1194 HG21 -5.0350 31.5890 16.9990 H 74 VAL74 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1202 1195 HG22 -4.3070 32.3950 15.5900 H 74 VAL74 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1203 1196 HG23 -3.3310 32.0990 17.0490 H 74 VAL74 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1204 1197 N -4.6170 36.9520 16.2870 N.am 75 LEU75 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1205 1198 CA -5.0430 38.3550 16.4890 C.3 75 LEU75 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1206 1199 C -6.5580 38.3360 16.5200 C.2 75 LEU75 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1207 1200 O -7.1800 37.9040 15.5180 O.2 75 LEU75 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1208 1201 CB -4.2930 39.1190 15.3690 C.3 75 LEU75 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1209 1202 CG -4.1400 40.6340 15.4800 C.3 75 LEU75 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1210 1203 CD1 -3.2190 41.0140 16.6610 C.3 75 LEU75 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1211 1204 CD2 -3.4690 41.1100 14.1850 C.3 75 LEU75 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1212 1205 H -4.7660 36.6000 15.3520 H 75 LEU75 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1213 1206 HA -4.5310 38.7690 17.3580 H 75 LEU75 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1214 1207 HB2 -3.2710 38.7460 15.2960 H 75 LEU75 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1215 1208 HB3 -4.8040 38.9660 14.4190 H 75 LEU75 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1216 1209 HG -5.1120 41.0840 15.6850 H 75 LEU75 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1217 1210 HD11 -3.1280 42.0990 16.7170 H 75 LEU75 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1218 1211 HD12 -3.6460 40.6380 17.5910 H 75 LEU75 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1219 1212 HD13 -2.2330 40.5740 16.5100 H 75 LEU75 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1220 1213 HD21 -3.3390 42.1920 14.2190 H 75 LEU75 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1221 1214 HD22 -2.4960 40.6300 14.0820 H 75 LEU75 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1222 1215 HD23 -4.0950 40.8470 13.3330 H 75 LEU75 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1223 1216 N -7.2060 38.7910 17.6020 N.am 76 SER76 -0.3006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1224 1217 CA -8.6680 38.7800 17.6790 C.3 76 SER76 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1225 1218 C -9.1050 39.6480 18.8880 C.2 76 SER76 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1226 1219 O -8.3890 39.6280 19.8730 O.2 76 SER76 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1227 1220 CB -9.1810 37.3690 17.9560 C.3 76 SER76 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1228 1221 OG -10.6240 37.4220 18.0210 O.3 76 SER76 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1229 1222 H -6.6850 39.1520 18.3880 H 76 SER76 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1230 1223 HA -9.0830 39.2490 16.7870 H 76 SER76 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1231 1224 HB2 -8.8650 36.7030 17.1530 H 76 SER76 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1232 1225 HB3 -8.7750 37.0140 18.9030 H 76 SER76 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1233 1226 HG -10.9690 36.5430 18.1950 H 76 SER76 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1234 1227 N -10.1800 40.3550 18.6840 N.am 77 ARG77 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1235 1228 CA -10.7970 41.1840 19.7200 C.3 77 ARG77 0.0995
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1236 1229 C -11.8660 40.3010 20.3690 C.2 77 ARG77 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1237 1230 O -12.1720 40.5480 21.5450 O.2 77 ARG77 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1238 1231 CB -11.3830 42.4540 19.1510 C.3 77 ARG77 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1239 1232 CG -10.6020 43.7350 18.9580 C.3 77 ARG77 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1240 1233 CD -11.0720 44.4790 17.7710 C.3 77 ARG77 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1241 1234 NE -11.9690 45.6070 17.6720 N.pl3 77 ARG77 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1242 1235 CZ -11.5910 46.8960 17.5500 C.cat 77 ARG77 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1243 1236 NH1 -10.3330 47.3320 17.7490 N.pl3 77 ARG77 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1244 1237 NH2 -12.4240 47.8240 17.1030 N.pl3 77 ARG77 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1245 1238 H -10.6260 40.3460 17.7780 H 77 ARG77 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1246 1239 HA -10.0330 41.5170 20.4230 H 77 ARG77 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1247 1240 HB2 -11.7520 42.2650 18.1430 H 77 ARG77 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1248 1241 HB3 -12.2070 42.7890 19.7820 H 77 ARG77 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1249 1242 HG2 -10.7230 44.3710 19.8350 H 77 ARG77 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1250 1243 HG3 -9.5460 43.5010 18.8230 H 77 ARG77 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1251 1244 HD2 -10.2170 44.9110 17.2510 H 77 ARG77 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1252 1245 HD3 -11.5990 43.8000 17.1010 H 77 ARG77 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1253 1246 HE -12.9500 45.3690 17.7000 H 77 ARG77 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1254 1247 HH12 -10.1150 48.3120 17.6410 H 77 ARG77 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1255 1248 HH11 -9.6070 46.6790 18.0060 H 77 ARG77 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1256 1249 HH22 -12.1160 48.7820 17.0210 H 77 ARG77 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1257 1250 HH21 -13.3670 47.5730 16.8440 H 77 ARG77 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1258 1251 N -12.4710 39.2980 19.7670 N.am 78 GLU78 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1259 1252 CA -13.5260 38.4690 20.3170 C.3 78 GLU78 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1260 1253 C -13.1670 37.2010 21.0860 C.2 78 GLU78 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1261 1254 O -14.0090 36.6820 21.8870 O.2 78 GLU78 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1262 1255 CB -14.5180 38.0730 19.1810 C.3 78 GLU78 -0.0209
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1263 1256 CG -15.0890 39.3090 18.4410 C.3 78 GLU78 -0.0111
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1264 1257 CD -16.3180 38.9840 17.6090 C.2 78 GLU78 0.0418
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1265 1258 OE1 -17.1340 39.8290 17.1920 O.co2 78 GLU78 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1266 1259 OE2 -16.3980 37.7340 17.5110 O.co2 78 GLU78 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1267 1260 H -12.2090 39.0420 18.8260 H 78 GLU78 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1268 1261 HA -14.1680 39.0740 20.9570 H 78 GLU78 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1269 1262 HB2 -14.0030 37.4500 18.4490 H 78 GLU78 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1270 1263 HB3 -15.3550 37.5180 19.6060 H 78 GLU78 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1271 1264 HG2 -15.3720 40.0700 19.1680 H 78 GLU78 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1272 1265 HG3 -14.3310 39.7130 17.7700 H 78 GLU78 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1273 1266 N -11.9750 36.6420 20.8880 N.am 79 LEU79 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1274 1267 CA -11.5600 35.4620 21.6370 C.3 79 LEU79 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1275 1268 C -11.1700 35.9430 23.0490 C.2 79 LEU79 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1276 1269 O -10.5860 36.9940 23.2810 O.2 79 LEU79 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1277 1270 CB -10.3920 34.7600 20.9290 C.3 79 LEU79 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1278 1271 CG -10.6350 34.2950 19.5190 C.3 79 LEU79 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1279 1272 CD1 -9.3660 33.5520 18.9870 C.3 79 LEU79 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1280 1273 CD2 -11.8180 33.3720 19.4480 C.3 79 LEU79 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1281 1274 H -11.3390 37.0350 20.2090 H 79 LEU79 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1282 1275 HA -12.3750 34.7380 21.6560 H 79 LEU79 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1283 1276 HB2 -9.5400 35.4380 20.8730 H 79 LEU79 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1284 1277 HB3 -10.1100 33.8680 21.4890 H 79 LEU79 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1285 1278 HG -10.8610 35.1540 18.8870 H 79 LEU79 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1286 1279 HD11 -9.5430 33.2150 17.9650 H 79 LEU79 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1287 1280 HD12 -8.5130 34.2310 19.0030 H 79 LEU79 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1288 1281 HD13 -9.1560 32.6910 19.6210 H 79 LEU79 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1289 1282 HD21 -11.9690 33.0530 18.4170 H 79 LEU79 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1290 1283 HD22 -11.6370 32.4990 20.0750 H 79 LEU79 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1291 1284 HD23 -12.7080 33.8930 19.8000 H 79 LEU79 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1292 1285 N -11.4780 35.0980 24.0350 N.am 80 LYS80 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1293 1286 CA -11.2300 35.3790 25.4510 C.3 80 LYS80 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1294 1287 C -9.9090 34.8420 25.9450 C.2 80 LYS80 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1295 1288 O -9.4040 35.2680 27.0000 O.2 80 LYS80 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1296 1289 CB -12.4010 34.7830 26.2310 C.3 80 LYS80 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1297 1290 CG -13.7720 35.1620 25.7170 C.3 80 LYS80 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1298 1291 CD -14.5360 36.1360 26.5760 C.3 80 LYS80 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1299 1292 CE -14.8540 37.4670 25.9870 C.3 80 LYS80 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1300 1293 NZ -15.4640 38.4500 26.8850 N.4 80 LYS80 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1301 1294 H -11.9070 34.2090 23.8220 H 80 LYS80 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1302 1295 HA -11.2800 36.4540 25.6230 H 80 LYS80 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1303 1296 HB2 -12.3450 33.6950 26.1960 H 80 LYS80 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1304 1297 HB3 -12.3540 35.1160 27.2680 H 80 LYS80 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1305 1298 HG2 -13.6770 35.6250 24.7350 H 80 LYS80 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1306 1299 HG3 -14.3910 34.2680 25.6380 H 80 LYS80 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1307 1300 HD2 -15.4990 35.7040 26.8480 H 80 LYS80 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1308 1301 HD3 -13.9650 36.3490 27.4800 H 80 LYS80 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1309 1302 HE2 -13.9390 37.9290 25.6170 H 80 LYS80 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1310 1303 HE3 -15.5560 37.3420 25.1620 H 80 LYS80 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1311 1304 HZ1 -15.6340 39.3080 26.3800 H 80 LYS80 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1312 1305 HZ2 -16.3390 38.0880 27.2370 H 80 LYS80 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1313 1306 HZ3 -14.8410 38.6330 27.6580 H 80 LYS80 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1314 1307 N -9.3420 33.9520 25.1730 N.am 81 GLU81 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1315 1308 CA -8.0620 33.2890 25.5020 C.3 81 GLU81 0.1000
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1316 1309 C -7.4860 32.6300 24.2650 C.2 81 GLU81 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1317 1310 O -8.1900 32.4110 23.2740 O.2 81 GLU81 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1318 1311 CB -8.4060 32.2060 26.5310 C.3 81 GLU81 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1319 1312 CG -8.8370 30.9140 25.8130 C.3 81 GLU81 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1320 1313 CD -10.1430 30.4000 26.3380 C.2 81 GLU81 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1321 1314 OE1 -10.9900 31.2010 26.7570 O.co2 81 GLU81 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1322 1315 OE2 -10.1670 29.1380 26.2500 O.co2 81 GLU81 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1323 1316 H -9.7800 33.6860 24.3020 H 81 GLU81 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1324 1317 HA -7.3410 34.0350 25.8360 H 81 GLU81 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1325 1318 HB2 -7.5310 31.9980 27.1470 H 81 GLU81 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1326 1319 HB3 -9.2220 32.5530 27.1650 H 81 GLU81 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1327 1320 HG2 -8.9490 31.1100 24.7470 H 81 GLU81 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1328 1321 HG3 -8.0800 30.1440 25.9630 H 81 GLU81 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1329 1322 N -6.1840 32.3590 24.2750 N.am 82 PRO82 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1330 1323 CA -5.5230 31.7670 23.1060 C.3 82 PRO82 0.1025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1331 1324 C -6.2140 30.4490 22.7630 C.2 82 PRO82 0.2367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1332 1325 O -6.4590 29.6410 23.6550 O.2 82 PRO82 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1333 1326 CB -4.0480 31.6760 23.4540 C.3 82 PRO82 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1334 1327 CG -3.8920 32.2230 24.8170 C.3 82 PRO82 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1335 1328 CD -5.2600 32.5840 25.3990 C.3 82 PRO82 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1336 1329 HA -5.5070 32.4910 22.2910 H 82 PRO82 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1337 1330 HB2 -3.7290 30.6340 23.4180 H 82 PRO82 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1338 1331 HB3 -3.4680 32.2570 22.7370 H 82 PRO82 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1339 1332 HG2 -3.4170 31.4780 25.4560 H 82 PRO82 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1340 1333 HG3 -3.2720 33.1180 24.7810 H 82 PRO82 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1341 1334 HD3 -5.3150 33.6270 25.7120 H 82 PRO82 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1342 1335 HD2 -5.5380 31.9400 26.2330 H 82 PRO82 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1343 1336 N -6.5560 30.3060 21.4890 N.am 83 PRO83 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1344 1337 CA -7.1610 29.0670 20.9960 C.3 83 PRO83 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1345 1338 C -6.1150 27.9970 21.2860 C.2 83 PRO83 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1346 1339 O -4.9180 28.2850 21.4220 O.2 83 PRO83 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1347 1340 CB -7.4350 29.2700 19.5260 C.3 83 PRO83 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1348 1341 CG -7.0390 30.6760 19.2080 C.3 83 PRO83 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1349 1342 CD -6.2570 31.2360 20.3850 C.3 83 PRO83 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1350 1343 HA -8.1010 28.8890 21.5180 H 83 PRO83 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1351 1344 HB2 -6.8470 28.5600 18.9450 H 83 PRO83 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1352 1345 HB3 -8.4950 29.1110 19.3280 H 83 PRO83 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1353 1346 HG2 -6.4190 30.6850 18.3120 H 83 PRO83 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1354 1347 HG3 -7.9330 31.2760 19.0370 H 83 PRO83 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1355 1348 HD3 -6.5860 32.2390 20.6550 H 83 PRO83 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1356 1349 HD2 -5.1830 31.2440 20.1970 H 83 PRO83 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1357 1350 N -6.5810 26.7700 21.4180 N.am 84 GLN84 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1358 1351 CA -5.7750 25.5960 21.7560 C.3 84 GLN84 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1359 1352 C -4.7310 25.4850 20.6670 C.2 84 GLN84 0.2338
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1360 1353 O -5.1340 25.6080 19.5010 O.2 84 GLN84 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1361 1354 CB -6.7570 24.4060 21.8570 C.3 84 GLN84 -0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1362 1355 CG -6.0880 23.0680 22.0350 C.3 84 GLN84 0.0259
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1363 1356 CD -7.0080 21.8650 22.2130 C.2 84 GLN84 0.2106
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1364 1357 OE1 -6.5980 20.7340 21.8790 O.2 84 GLN84 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1365 1358 NE2 -8.2340 22.0900 22.7320 N.am 84 GLN84 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1366 1359 H -7.5650 26.5860 21.2830 H 84 GLN84 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1367 1360 HA -5.3600 25.7150 22.7570 H 84 GLN84 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1368 1361 HB2 -7.4170 24.5500 22.7130 H 84 GLN84 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1369 1362 HB3 -7.3520 24.3470 20.9460 H 84 GLN84 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1370 1363 HG2 -5.4770 22.8480 21.1600 H 84 GLN84 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1371 1364 HG3 -5.4560 23.0930 22.9230 H 84 GLN84 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1372 1365 HE22 -8.8740 21.3210 22.8660 H 84 GLN84 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1373 1366 HE21 -8.5110 23.0280 22.9860 H 84 GLN84 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1374 1367 N -3.4560 25.3390 21.0080 N.am 85 GLY85 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1375 1368 CA -2.4270 25.2040 19.9720 C.3 85 GLY85 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1376 1369 C -1.6930 26.4820 19.6100 C.2 85 GLY85 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1377 1370 O -0.5700 26.3800 19.0760 O.2 85 GLY85 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1378 1371 H -3.1930 25.3210 21.9830 H 85 GLY85 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1379 1372 HA2 -1.6670 24.4970 20.3040 H 85 GLY85 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1380 1373 HA3 -2.8830 24.8400 19.0510 H 85 GLY85 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1381 1374 N -2.2750 27.6380 19.8530 N.am 86 ALA86 -0.3030
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1382 1375 CA -1.6770 28.9320 19.5560 C.3 86 ALA86 0.0966
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1383 1376 C -0.7650 29.2790 20.7610 C.2 86 ALA86 0.2337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1384 1377 O -1.0300 28.8840 21.9040 O.2 86 ALA86 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1385 1378 CB -2.6280 30.0860 19.3690 C.3 86 ALA86 -0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1386 1379 H -3.1940 27.6630 20.2710 H 86 ALA86 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1387 1380 HA -1.0900 28.8600 18.6410 H 86 ALA86 0.0592
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1388 1381 HB1 -2.0620 30.9920 19.1530 H 86 ALA86 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1389 1382 HB2 -3.3010 29.8720 18.5390 H 86 ALA86 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1390 1383 HB3 -3.2100 30.2290 20.2800 H 86 ALA86 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1391 1384 N 0.2740 30.0050 20.4660 N.am 87 HIS87 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1392 1385 CA 1.2210 30.4070 21.5170 C.3 87 HIS87 0.1048
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1393 1386 C 0.7970 31.6920 22.1850 C.2 87 HIS87 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1394 1387 O 0.9520 31.8050 23.4060 O.2 87 HIS87 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1395 1388 CB 2.6570 30.5270 20.9380 C.3 87 HIS87 0.0160
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1396 1389 CG 3.0410 29.2900 20.2260 C.ar 87 HIS87 0.0375
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1397 1390 ND1 3.4510 28.1300 20.8220 N.ar 87 HIS87 -0.3481
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1398 1391 CD2 3.0460 29.0500 18.8940 C.ar 87 HIS87 0.0485
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1399 1392 CE1 3.6970 27.2330 19.8310 C.ar 87 HIS87 0.0935
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1400 1393 NE2 3.4690 27.8020 18.6500 N.ar 87 HIS87 -0.2440
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1401 1394 H 0.4330 30.2950 19.5120 H 87 HIS87 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1402 1395 HA 1.3300 29.5970 22.2380 H 87 HIS87 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1403 1396 HB2 2.6990 31.3620 20.2390 H 87 HIS87 0.0351
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1404 1397 HB3 3.3640 30.6980 21.7500 H 87 HIS87 0.0351
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1405 1398 HD1 3.5180 28.0760 21.8280 H 87 HIS87 0.1665
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1406 1399 HD2 2.7350 29.8210 18.2050 H 87 HIS87 0.0848
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1407 1400 HE1 4.0250 26.2340 20.0760 H 87 HIS87 0.1027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1408 1401 N 0.2880 32.6250 21.4530 N.am 88 PHE88 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1409 1402 CA -0.1330 33.9360 21.9180 C.3 88 PHE88 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1410 1403 C -1.4530 34.4000 21.2540 C.2 88 PHE88 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1411 1404 O -1.7760 33.9700 20.1300 O.2 88 PHE88 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1412 1405 CB 0.9330 35.0170 21.5960 C.3 88 PHE88 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1413 1406 CG 2.2400 34.7490 22.3040 C.ar 88 PHE88 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1414 1407 CD1 3.2380 34.0170 21.6740 C.ar 88 PHE88 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1415 1408 CD2 2.4090 35.1540 23.6460 C.ar 88 PHE88 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1416 1409 CE1 4.4250 33.6980 22.3310 C.ar 88 PHE88 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1417 1410 CE2 3.5920 34.8420 24.3000 C.ar 88 PHE88 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1418 1411 CZ 4.6240 34.1180 23.6360 C.ar 88 PHE88 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1419 1412 H 0.1520 32.4730 20.4640 H 88 PHE88 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1420 1413 HA -0.2970 33.9050 22.9950 H 88 PHE88 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1421 1414 HB2 1.1240 35.0320 20.5230 H 88 PHE88 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1422 1415 HB3 0.5680 35.9940 21.9130 H 88 PHE88 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1423 1416 HD1 3.1020 33.6840 20.6560 H 88 PHE88 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1424 1417 HD2 1.6230 35.6990 24.1490 H 88 PHE88 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1425 1418 HE1 5.1860 33.1250 21.8230 H 88 PHE88 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1426 1419 HE2 3.7390 35.1480 25.3250 H 88 PHE88 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1427 1420 HZ 5.5540 33.8960 24.1390 H 88 PHE88 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1428 1421 N -2.0920 35.3220 21.9600 N.am 89 LEU89 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1429 1422 CA -3.3210 35.9820 21.4790 C.3 89 LEU89 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1430 1423 C -3.0180 37.4510 21.7550 C.2 89 LEU89 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1431 1424 O -2.5190 37.7830 22.8550 O.2 89 LEU89 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1432 1425 CB -4.6250 35.5640 22.1460 C.3 89 LEU89 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1433 1426 CG -5.8470 36.4370 21.9290 C.3 89 LEU89 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1434 1427 CD1 -6.3900 36.0930 20.5570 C.3 89 LEU89 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1435 1428 CD2 -6.9110 36.2560 23.0190 C.3 89 LEU89 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1436 1429 H -1.7400 35.5980 22.8660 H 89 LEU89 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1437 1430 HA -3.4670 35.7550 20.4230 H 89 LEU89 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1438 1431 HB2 -4.9160 34.5760 21.7890 H 89 LEU89 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1439 1432 HB3 -4.4870 35.5330 23.2270 H 89 LEU89 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1440 1433 HG -5.5680 37.4860 22.0310 H 89 LEU89 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1441 1434 HD11 -7.2740 36.6980 20.3530 H 89 LEU89 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1442 1435 HD12 -5.6300 36.2970 19.8030 H 89 LEU89 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1443 1436 HD13 -6.6580 35.0370 20.5260 H 89 LEU89 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1444 1437 HD21 -7.7610 36.9060 22.8100 H 89 LEU89 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1445 1438 HD22 -7.2430 35.2180 23.0340 H 89 LEU89 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1446 1439 HD23 -6.4860 36.5150 23.9890 H 89 LEU89 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1447 1440 N -3.3370 38.2960 20.8070 N.am 90 SER90 -0.3006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1448 1441 CA -3.1700 39.7460 20.9140 C.3 90 SER90 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1449 1442 C -4.4570 40.3530 20.3260 C.2 90 SER90 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1450 1443 O -5.0500 39.7600 19.4030 O.2 90 SER90 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1451 1444 CB -1.9400 40.3180 20.2250 C.3 90 SER90 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1452 1445 OG -0.7710 39.6160 20.6530 O.3 90 SER90 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1453 1446 H -3.7240 37.9570 19.9380 H 90 SER90 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1454 1447 HA -2.9940 40.0160 21.9550 H 90 SER90 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1455 1448 HB2 -2.0460 40.2130 19.1450 H 90 SER90 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1456 1449 HB3 -1.8380 41.3730 20.4790 H 90 SER90 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1457 1450 HG 0.0010 39.9820 20.2150 H 90 SER90 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1458 1451 N -4.8670 41.4970 20.8410 N.am 91 ARG91 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1459 1452 CA -6.0520 42.2060 20.4000 C.3 91 ARG91 0.0995
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1460 1453 C -5.7870 43.1270 19.2070 C.2 91 ARG91 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1461 1454 O -6.7650 43.6430 18.6220 O.2 91 ARG91 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1462 1455 CB -6.7580 43.0070 21.5280 C.3 91 ARG91 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1463 1456 CG -7.4960 44.2370 21.0000 C.3 91 ARG91 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1464 1457 CD -8.0840 45.3030 21.8360 C.3 91 ARG91 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1465 1458 NE -9.4980 45.4720 22.0200 N.pl3 91 ARG91 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1466 1459 CZ -10.4430 46.3680 22.2810 C.cat 91 ARG91 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1467 1460 NH1 -11.7220 45.9800 22.5300 N.pl3 91 ARG91 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1468 1461 NH2 -10.2660 47.7060 22.2950 N.pl3 91 ARG91 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1469 1462 H -4.3450 41.9300 21.5890 H 91 ARG91 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1470 1463 HA -6.8490 41.4910 20.1970 H 91 ARG91 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1471 1464 HB2 -7.4870 42.3680 22.0270 H 91 ARG91 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1472 1465 HB3 -6.0170 43.3460 22.2520 H 91 ARG91 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1473 1466 HG2 -6.8280 44.8160 20.3620 H 91 ARG91 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1474 1467 HG3 -8.3650 43.9200 20.4230 H 91 ARG91 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1475 1468 HD2 -7.7300 45.1980 22.8620 H 91 ARG91 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1476 1469 HD3 -7.7850 46.2770 21.4470 H 91 ARG91 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1477 1470 HE -9.7460 44.5040 21.8760 H 91 ARG91 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1478 1471 HH12 -12.4300 46.6720 22.7270 H 91 ARG91 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1479 1472 HH11 -11.9640 44.9990 22.5180 H 91 ARG91 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1480 1473 HH22 -11.0430 48.3160 22.5040 H 91 ARG91 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1481 1474 HH21 -9.3560 48.0970 22.0960 H 91 ARG91 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1482 1475 N -4.5790 43.3820 18.8040 N.am 92 SER92 -0.3006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1483 1476 CA -4.2720 44.2460 17.6690 C.3 92 SER92 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1484 1477 C -2.8230 43.9820 17.1870 C.2 92 SER92 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1485 1478 O -2.0250 43.3990 17.8910 O.2 92 SER92 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1486 1479 CB -4.4900 45.7190 18.0160 C.3 92 SER92 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1487 1480 OG -3.4240 46.1600 18.8620 O.3 92 SER92 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1488 1481 H -3.7900 42.9730 19.2840 H 92 SER92 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1489 1482 HA -5.0100 44.0890 16.8820 H 92 SER92 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1490 1483 HB2 -4.5020 46.3110 17.1010 H 92 SER92 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1491 1484 HB3 -5.4420 45.8340 18.5340 H 92 SER92 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1492 1485 HG -3.5530 47.0850 19.0850 H 92 SER92 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1493 1486 N -2.6090 44.4230 15.9600 N.am 93 LEU93 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1494 1487 CA -1.2940 44.2970 15.3180 C.3 93 LEU93 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1495 1488 C -0.2680 44.9640 16.2420 C.2 93 LEU93 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1496 1489 O 0.7930 44.4470 16.5710 O.2 93 LEU93 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1497 1490 CB -1.3090 44.9560 13.9420 C.3 93 LEU93 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1498 1491 CG -0.4020 44.3520 12.8660 C.3 93 LEU93 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1499 1492 CD1 -0.0250 45.3930 11.8320 C.3 93 LEU93 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1500 1493 CD2 0.8210 43.6940 13.4690 C.3 93 LEU93 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1501 1494 H -3.3590 44.8580 15.4420 H 93 LEU93 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1502 1495 HA -1.0660 43.2430 15.1590 H 93 LEU93 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1503 1496 HB2 -2.3170 44.9140 13.5290 H 93 LEU93 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1504 1497 HB3 -0.9980 45.9970 14.0340 H 93 LEU93 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1505 1498 HG -0.8860 43.4770 12.4310 H 93 LEU93 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1506 1499 HD11 0.6190 44.9400 11.0780 H 93 LEU93 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1507 1500 HD12 -0.9270 45.7760 11.3550 H 93 LEU93 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1508 1501 HD13 0.5050 46.2130 12.3170 H 93 LEU93 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1509 1502 HD21 1.4390 43.2780 12.6740 H 93 LEU93 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1510 1503 HD22 1.3960 44.4350 14.0250 H 93 LEU93 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1511 1504 HD23 0.5100 42.8960 14.1430 H 93 LEU93 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1512 1505 N -0.6480 46.1830 16.6050 N.am 94 ASP94 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1513 1506 CA 0.1620 47.0360 17.5010 C.3 94 ASP94 0.1052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1514 1507 C 0.6700 46.2660 18.7330 C.2 94 ASP94 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1515 1508 O 1.8750 46.2140 19.0010 O.2 94 ASP94 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1516 1509 CB -0.7230 48.1940 17.9410 C.3 94 ASP94 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1517 1510 CG -0.9080 49.3020 16.9170 C.2 94 ASP94 0.0893
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1518 1511 OD1 -2.0020 49.9210 16.8560 O.co2 94 ASP94 -0.3089
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1519 1512 OD2 0.0830 49.6040 16.2190 O.co2 94 ASP94 -0.8475
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1520 1513 H -1.5210 46.5610 16.2670 H 94 ASP94 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1521 1514 HA 1.0210 47.4260 16.9540 H 94 ASP94 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1522 1515 HB2 -1.7210 47.8210 18.1740 H 94 ASP94 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1523 1516 HB3 -0.2950 48.6630 18.8270 H 94 ASP94 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1524 1517 N -0.2720 45.6670 19.4410 N.am 95 ASP95 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1525 1518 CA 0.0220 44.8700 20.6310 C.3 95 ASP95 0.1052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1526 1519 C 0.8870 43.6600 20.2900 C.2 95 ASP95 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1527 1520 O 1.7870 43.3370 21.0890 O.2 95 ASP95 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1528 1521 CB -1.1940 44.3900 21.3910 C.3 95 ASP95 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1529 1522 CG -1.8860 45.5380 22.1140 C.2 95 ASP95 0.0893
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1530 1523 OD1 -2.8750 45.2160 22.7710 O.co2 95 ASP95 -0.3089
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1531 1524 OD2 -1.3900 46.6630 21.9240 O.co2 95 ASP95 -0.8475
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1532 1525 H -1.2400 45.7500 19.1660 H 95 ASP95 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1533 1526 HA 0.4960 45.5000 21.3830 H 95 ASP95 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1534 1527 HB2 -1.9040 43.9410 20.6960 H 95 ASP95 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1535 1528 HB3 -0.8920 43.6480 22.1300 H 95 ASP95 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1536 1529 N 0.5810 43.0150 19.1490 N.am 96 ALA96 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1537 1530 CA 1.4330 41.8570 18.7750 C.3 96 ALA96 0.0966
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1538 1531 C 2.9100 42.2200 18.6130 C.2 96 ALA96 0.2337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1539 1532 O 3.8910 41.5870 19.0740 O.2 96 ALA96 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1540 1533 CB 0.8840 41.2690 17.4500 C.3 96 ALA96 -0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1541 1534 H -0.2000 43.3240 18.5880 H 96 ALA96 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1542 1535 HA 1.3390 41.0770 19.5300 H 96 ALA96 0.0592
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1543 1536 HB1 1.4920 40.4150 17.1510 H 96 ALA96 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1544 1537 HB2 -0.1470 40.9470 17.5950 H 96 ALA96 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1545 1538 HB3 0.9200 42.0310 16.6710 H 96 ALA96 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1546 1539 N 3.1510 43.2800 17.9080 N.am 97 LEU97 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1547 1540 CA 4.4500 43.8900 17.5970 C.3 97 LEU97 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1548 1541 C 5.0480 44.3570 18.9250 C.2 97 LEU97 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1549 1542 O 6.2480 44.0910 19.0890 O.2 97 LEU97 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1550 1543 CB 4.2110 44.9440 16.5280 C.3 97 LEU97 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1551 1544 CG 3.7870 44.5270 15.1240 C.3 97 LEU97 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1552 1545 CD1 3.8300 45.7680 14.2560 C.3 97 LEU97 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1553 1546 CD2 4.8110 43.5240 14.5890 C.3 97 LEU97 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1554 1547 H 2.3880 43.7950 17.4930 H 97 LEU97 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1555 1548 HA 5.0510 43.1900 17.0160 H 97 LEU97 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1556 1549 HB2 3.4180 45.6170 16.8520 H 97 LEU97 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1557 1550 HB3 5.1270 45.5130 16.3670 H 97 LEU97 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1558 1551 HG 2.7590 44.1670 15.1460 H 97 LEU97 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1559 1552 HD11 3.5320 45.5110 13.2390 H 97 LEU97 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1560 1553 HD12 3.1460 46.5160 14.6570 H 97 LEU97 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1561 1554 HD13 4.8430 46.1710 14.2470 H 97 LEU97 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1562 1555 HD21 4.5250 43.2130 13.5840 H 97 LEU97 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1563 1556 HD22 5.7960 43.9910 14.5580 H 97 LEU97 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1564 1557 HD23 4.8430 42.6530 15.2430 H 97 LEU97 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1565 1558 N 4.2220 44.9390 19.8080 N.am 98 LYS98 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1566 1559 CA 4.6970 45.3680 21.1370 C.3 98 LYS98 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1567 1560 C 5.2130 44.1480 21.9040 C.2 98 LYS98 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1568 1561 O 6.2110 44.1690 22.6400 O.2 98 LYS98 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1569 1562 CB 3.6560 46.0090 22.0490 C.3 98 LYS98 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1570 1563 CG 3.2410 47.4410 21.8460 C.3 98 LYS98 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1571 1564 CD 2.3150 48.1270 22.8160 C.3 98 LYS98 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1572 1565 CE 0.8350 47.9800 22.7730 C.3 98 LYS98 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1573 1566 NZ 0.1240 48.7130 21.6740 N.4 98 LYS98 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1574 1567 H 3.2530 45.0910 19.5680 H 98 LYS98 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1575 1568 HA 5.5150 46.0790 21.0190 H 98 LYS98 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1576 1569 HB2 2.7190 45.4560 21.9770 H 98 LYS98 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1577 1570 HB3 4.0120 45.9870 23.0790 H 98 LYS98 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1578 1571 HG2 4.1240 48.0790 21.8460 H 98 LYS98 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1579 1572 HG3 2.7230 47.5380 20.8920 H 98 LYS98 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1580 1573 HD2 2.5490 47.8060 23.8310 H 98 LYS98 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1581 1574 HD3 2.4420 49.2070 22.7380 H 98 LYS98 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1582 1575 HE2 0.5770 46.9290 22.6460 H 98 LYS98 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1583 1576 HE3 0.4060 48.3490 23.7040 H 98 LYS98 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1584 1577 HZ1 -0.8690 48.5420 21.7420 H 98 LYS98 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1585 1578 HZ2 0.3010 49.7040 21.7600 H 98 LYS98 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1586 1579 HZ3 0.4600 48.3880 20.7790 H 98 LYS98 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1587 1580 N 4.5090 43.0510 21.6900 N.am 99 LEU99 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1588 1581 CA 4.8230 41.7640 22.3320 C.3 99 LEU99 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1589 1582 C 6.1900 41.2530 21.9450 C.2 99 LEU99 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1590 1583 O 6.8010 40.5280 22.7710 O.2 99 LEU99 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1591 1584 CB 3.6170 40.8390 22.1160 C.3 99 LEU99 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1592 1585 CG 3.5100 39.4530 22.6580 C.3 99 LEU99 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1593 1586 CD1 3.5170 39.3470 24.1830 C.3 99 LEU99 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1594 1587 CD2 2.2030 38.7740 22.1940 C.3 99 LEU99 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1595 1588 H 3.7170 43.0730 21.0630 H 99 LEU99 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1596 1589 HA 4.6060 41.8270 23.3980 H 99 LEU99 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1597 1590 HB2 2.7230 41.3050 22.5300 H 99 LEU99 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1598 1591 HB3 3.4760 40.6680 21.0490 H 99 LEU99 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1599 1592 HG 4.3470 38.8560 22.2970 H 99 LEU99 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1600 1593 HD11 3.4350 38.3000 24.4750 H 99 LEU99 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1601 1594 HD12 4.4470 39.7610 24.5720 H 99 LEU99 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1602 1595 HD13 2.6740 39.9050 24.5900 H 99 LEU99 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1603 1596 HD21 2.1520 37.7650 22.6040 H 99 LEU99 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1604 1597 HD22 1.3480 39.3520 22.5450 H 99 LEU99 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1605 1598 HD23 2.1850 38.7250 21.1050 H 99 LEU99 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1606 1599 N 6.6960 41.5950 20.7830 N.am 100 THR100 -0.3003
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1607 1600 CA 7.9970 41.1690 20.2730 C.3 100 THR100 0.1252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1608 1601 C 9.1520 42.0540 20.7450 C.2 100 THR100 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1609 1602 O 9.9890 42.4730 19.9110 O.2 100 THR100 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1610 1603 CB 8.0570 41.1980 18.6880 C.3 100 THR100 0.0792
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1611 1604 OG1 8.0540 42.6250 18.3650 O.3 100 THR100 -0.3897
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1612 1605 CG2 6.9180 40.4720 17.9810 C.3 100 THR100 -0.0367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1613 1606 H 6.1750 42.1990 20.1640 H 100 THR100 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1614 1607 HA 8.2090 40.1560 20.6160 H 100 THR100 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1615 1608 HB 8.9500 40.6740 18.3480 H 100 THR100 0.0614
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1616 1609 HG1 8.0890 42.7380 17.4120 H 100 THR100 0.2099
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1617 1610 HG21 7.0510 40.5500 16.9020 H 100 THR100 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1618 1611 HG22 6.9200 39.4210 18.2720 H 100 THR100 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1619 1612 HG23 5.9670 40.9250 18.2630 H 100 THR100 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1620 1613 N 9.2110 42.3200 22.0250 N.am 101 GLU101 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1621 1614 CA 10.2470 43.1570 22.6420 C.3 101 GLU101 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1622 1615 C 10.4290 42.5830 24.0500 C.2 101 GLU101 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1623 1616 O 11.5210 42.2540 24.5190 O.2 101 GLU101 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1624 1617 CB 9.7760 44.5790 22.8880 C.3 101 GLU101 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1625 1618 CG 9.0910 45.2800 21.7220 C.3 101 GLU101 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1626 1619 CD 10.0340 45.9670 20.7750 C.2 101 GLU101 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1627 1620 OE1 10.6720 46.9670 21.0790 O.co2 101 GLU101 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1628 1621 OE2 10.0980 45.4050 19.6620 O.co2 101 GLU101 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1629 1622 H 8.5160 41.9410 22.6520 H 101 GLU101 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1630 1623 HA 11.2000 42.9840 22.1420 H 101 GLU101 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1631 1624 HB2 9.0540 44.5870 23.7050 H 101 GLU101 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1632 1625 HB3 10.6290 45.2040 23.1510 H 101 GLU101 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1633 1626 HG2 8.5280 44.5510 21.1390 H 101 GLU101 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1634 1627 HG3 8.4110 46.0420 22.1040 H 101 GLU101 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1635 1628 N 9.2410 42.5080 24.6380 N.am 102 GLN102 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1636 1629 CA 9.2080 41.9480 25.9980 C.3 102 GLN102 0.1001
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1637 1630 C 9.9410 40.6130 25.9700 C.2 102 GLN102 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1638 1631 O 9.8550 39.8310 25.0230 O.2 102 GLN102 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1639 1632 CB 7.7960 41.9300 26.5710 C.3 102 GLN102 -0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1640 1633 CG 7.6940 43.2890 27.2860 C.3 102 GLN102 0.0259
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1641 1634 CD 6.4430 43.4470 28.1000 C.2 102 GLN102 0.2106
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1642 1635 OE1 6.0280 44.5790 28.3720 O.2 102 GLN102 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1643 1636 NE2 5.8900 42.2860 28.4560 N.am 102 GLN102 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1644 1637 H 8.4160 42.8280 24.1510 H 102 GLN102 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1645 1638 HA 9.5530 42.6990 26.7090 H 102 GLN102 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1646 1639 HB2 7.0750 41.8290 25.7600 H 102 GLN102 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1647 1640 HB3 7.6920 41.0880 27.2560 H 102 GLN102 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1648 1641 HG2 8.5400 43.4080 27.9630 H 102 GLN102 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1649 1642 HG3 7.7050 44.0900 26.5470 H 102 GLN102 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1650 1643 HE22 5.0430 42.2780 29.0070 H 102 GLN102 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1651 1644 HE21 6.3180 41.4150 28.1750 H 102 GLN102 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1652 1645 N 10.7210 40.4100 27.0110 N.am 103 PRO103 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1653 1646 CA 11.5160 39.2430 27.3540 C.3 103 PRO103 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1654 1647 C 11.4080 37.9140 26.6240 C.2 103 PRO103 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1655 1648 O 12.4200 37.2800 26.2230 O.2 103 PRO103 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1656 1649 CB 10.9080 39.0100 28.7890 C.3 103 PRO103 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1657 1650 CG 10.4620 40.3580 29.3030 C.3 103 PRO103 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1658 1651 CD 10.8570 41.3420 28.1890 C.3 103 PRO103 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1659 1652 HA 12.5680 39.4490 27.1570 H 103 PRO103 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1660 1653 HB2 10.0630 38.3250 28.7190 H 103 PRO103 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1661 1654 HB3 11.6690 38.5820 29.4410 H 103 PRO103 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1662 1655 HG2 9.3850 40.3450 29.4720 H 103 PRO103 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1663 1656 HG3 10.9730 40.5770 30.2400 H 103 PRO103 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1664 1657 HD3 11.8820 41.7070 28.2480 H 103 PRO103 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1665 1658 HD2 10.1780 42.1860 28.0660 H 103 PRO103 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1666 1659 N 10.1680 37.4450 26.4860 N.am 104 GLU104 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1667 1660 CA 9.8940 36.1780 25.8060 C.3 104 GLU104 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1668 1661 C 9.9370 36.2540 24.2790 C.2 104 GLU104 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1669 1662 O 10.6200 35.3970 23.6680 O.2 104 GLU104 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1670 1663 CB 8.5470 35.5360 26.1360 C.3 104 GLU104 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1671 1664 CG 8.5680 34.0270 25.7920 C.3 104 GLU104 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1672 1665 CD 7.2560 33.4060 26.1850 C.2 104 GLU104 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1673 1666 OE1 6.4930 34.1130 26.8300 O.co2 104 GLU104 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1674 1667 OE2 7.0720 32.2370 25.8060 O.co2 104 GLU104 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1675 1668 H 9.3870 37.9670 26.8560 H 104 GLU104 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1676 1669 HA 10.6090 35.4250 26.1370 H 104 GLU104 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1677 1670 HB2 8.3390 35.6540 27.1990 H 104 GLU104 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1678 1671 HB3 7.7610 36.0200 25.5560 H 104 GLU104 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1679 1672 HG2 8.7240 33.9000 24.7210 H 104 GLU104 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1680 1673 HG3 9.3780 33.5410 26.3360 H 104 GLU104 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1681 1674 N 9.2530 37.2040 23.6690 N.am 105 LEU105 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1682 1675 CA 9.3030 37.2700 22.1930 C.3 105 LEU105 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1683 1676 C 10.2990 38.3040 21.7020 C.2 105 LEU105 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1684 1677 O 9.8510 39.1340 20.8730 O.2 105 LEU105 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1685 1678 CB 7.8700 37.5500 21.6940 C.3 105 LEU105 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1686 1679 CG 7.0090 36.3080 21.5370 C.3 105 LEU105 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1687 1680 CD1 6.0130 36.5030 20.3980 C.3 105 LEU105 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1688 1681 CD2 7.8920 35.1050 21.2500 C.3 105 LEU105 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1689 1682 H 8.7120 37.8640 24.2100 H 105 LEU105 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1690 1683 HA 9.5290 36.2820 21.7920 H 105 LEU105 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1691 1684 HB2 7.3600 38.2040 22.4010 H 105 LEU105 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1692 1685 HB3 7.9130 38.0340 20.7180 H 105 LEU105 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1693 1686 HG 6.4760 36.1140 22.4680 H 105 LEU105 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1694 1687 HD11 5.4000 35.6080 20.2930 H 105 LEU105 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1695 1688 HD12 5.3720 37.3570 20.6170 H 105 LEU105 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1696 1689 HD13 6.5540 36.6840 19.4690 H 105 LEU105 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1697 1690 HD21 7.2710 34.2160 21.1380 H 105 LEU105 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1698 1691 HD22 8.4510 35.2750 20.3300 H 105 LEU105 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1699 1692 HD23 8.5880 34.9590 22.0760 H 105 LEU105 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1700 1693 N 11.5230 38.3110 22.1730 N.am 106 ALA106 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1701 1694 CA 12.4560 39.3650 21.6830 C.3 106 ALA106 0.0966
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1702 1695 C 13.7440 38.7170 21.1660 C.2 106 ALA106 0.2337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1703 1696 O 14.1170 38.9470 20.0030 O.2 106 ALA106 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1704 1697 CB 12.7080 40.4400 22.7170 C.3 106 ALA106 -0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1705 1698 H 11.8090 37.6150 22.8470 H 106 ALA106 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1706 1699 HA 11.9420 39.9980 20.9600 H 106 ALA106 0.0592
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1707 1700 HB1 13.3940 41.1830 22.3100 H 106 ALA106 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1708 1701 HB2 11.7660 40.9210 22.9790 H 106 ALA106 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1709 1702 HB3 13.1460 39.9920 23.6090 H 106 ALA106 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1710 1703 N 14.3200 37.9230 22.0340 N.am 107 ASN107 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1711 1704 CA 15.5390 37.1260 21.8390 C.3 107 ASN107 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1712 1705 C 15.1300 35.9410 20.9460 C.2 107 ASN107 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1713 1706 O 16.0290 35.2390 20.4610 O.2 107 ASN107 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1714 1707 CB 16.0910 36.7040 23.1690 C.3 107 ASN107 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1715 1708 CG 17.1770 36.0590 23.9300 C.2 107 ASN107 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1716 1709 OD1 18.3160 35.6560 23.5710 O.2 107 ASN107 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1717 1710 ND2 16.9420 35.8510 25.2690 N.am 107 ASN107 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1718 1711 H 13.9230 37.8100 22.9560 H 107 ASN107 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1719 1712 HA 16.3170 37.7520 21.4010 H 107 ASN107 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1720 1713 HB2 16.2220 37.5810 23.8030 H 107 ASN107 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1721 1714 HB3 15.3990 36.0100 23.6470 H 107 ASN107 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1722 1715 HD22 17.6480 35.4130 25.8440 H 107 ASN107 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1723 1716 HD21 16.0630 36.1360 25.6780 H 107 ASN107 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1724 1717 N 13.8280 35.7370 20.7450 N.am 108 LYS108 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1725 1718 CA 13.3250 34.6050 19.9730 C.3 108 LYS108 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1726 1719 C 12.8420 34.7720 18.5270 C.2 108 LYS108 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1727 1720 O 12.8260 33.7310 17.8700 O.2 108 LYS108 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1728 1721 CB 12.0470 33.9620 20.5980 C.3 108 LYS108 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1729 1722 CG 12.1860 33.1960 21.8920 C.3 108 LYS108 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1730 1723 CD 10.8850 32.7790 22.5670 C.3 108 LYS108 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1731 1724 CE 11.1860 32.1570 23.9290 C.3 108 LYS108 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1732 1725 NZ 9.9940 31.4240 24.4610 N.4 108 LYS108 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1733 1726 H 13.1510 36.3780 21.1330 H 108 LYS108 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1734 1727 HA 14.1150 33.8630 19.8570 H 108 LYS108 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1735 1728 HB2 11.3160 34.7410 20.8130 H 108 LYS108 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1736 1729 HB3 11.6190 33.2470 19.8960 H 108 LYS108 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1737 1730 HG2 12.7410 32.2750 21.7120 H 108 LYS108 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1738 1731 HG3 12.7210 33.8060 22.6200 H 108 LYS108 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1739 1732 HD2 10.2490 33.6540 22.7030 H 108 LYS108 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1740 1733 HD3 10.3690 32.0490 21.9430 H 108 LYS108 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1741 1734 HE2 12.0130 31.4540 23.8330 H 108 LYS108 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1742 1735 HE3 11.4570 32.9420 24.6360 H 108 LYS108 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1743 1736 HZ1 10.2190 31.0230 25.3600 H 108 LYS108 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1744 1737 HZ2 9.2210 32.0660 24.5630 H 108 LYS108 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1745 1738 HZ3 9.7370 30.6880 23.8190 H 108 LYS108 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1746 1739 N 12.4460 35.9560 18.1560 N.am 109 VAL109 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1747 1740 CA 11.8850 36.1000 16.7840 C.3 109 VAL109 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1748 1741 C 12.8600 36.6720 15.7560 C.2 109 VAL109 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1749 1742 O 13.5130 37.6870 16.0510 O.2 109 VAL109 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1750 1743 CB 10.6630 37.0310 16.9050 C.3 109 VAL109 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1751 1744 CG1 10.0810 37.4390 15.5310 C.3 109 VAL109 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1752 1745 CG2 9.5740 36.4250 17.7460 C.3 109 VAL109 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1753 1746 H 12.5250 36.7370 18.7910 H 109 VAL109 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1754 1747 HA 11.5540 35.1270 16.4220 H 109 VAL109 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1755 1748 HB 10.9330 37.9120 17.4870 H 109 VAL109 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1756 1749 HG11 9.2230 38.0940 15.6790 H 109 VAL109 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1757 1750 HG12 10.8430 37.9640 14.9540 H 109 VAL109 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1758 1751 HG13 9.7670 36.5470 14.9900 H 109 VAL109 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1759 1752 HG21 8.7320 37.1150 17.8040 H 109 VAL109 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1760 1753 HG22 9.2450 35.4890 17.2950 H 109 VAL109 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1761 1754 HG23 9.9540 36.2310 18.7490 H 109 VAL109 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1762 1755 N 12.7910 36.0130 14.6170 N.am 110 ASP110 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1763 1756 CA 13.5590 36.4640 13.4520 C.3 110 ASP110 0.1045
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1764 1757 C 12.6090 37.3090 12.6100 C.2 110 ASP110 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1765 1758 O 12.4630 38.5130 12.8800 O.2 110 ASP110 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1766 1759 CB 14.1520 35.2950 12.7250 C.3 110 ASP110 0.0138
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1767 1760 CG 15.0200 35.6500 11.5100 C.2 110 ASP110 0.0440
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1768 1761 OD1 15.2900 34.7000 10.7590 O.co2 110 ASP110 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1769 1762 OD2 15.3820 36.8290 11.3540 O.co2 110 ASP110 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1770 1763 H 12.2070 35.1920 14.5430 H 110 ASP110 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1771 1764 HA 14.4580 36.9820 13.7870 H 110 ASP110 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1772 1765 HB2 14.7890 34.7290 13.4050 H 110 ASP110 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1773 1766 HB3 13.3530 34.6520 12.3560 H 110 ASP110 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1774 1767 N 11.9270 36.7010 11.6290 N.am 111 MET111 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1775 1768 CA 11.0050 37.4510 10.7800 C.3 111 MET111 0.1002
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1776 1769 C 9.5560 37.3850 11.3030 C.2 111 MET111 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1777 1770 O 9.2080 36.4130 11.9570 O.2 111 MET111 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1778 1771 CB 10.9990 36.8450 9.3490 C.3 111 MET111 -0.0169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1779 1772 CG 12.4420 36.7990 8.9060 C.3 111 MET111 -0.0044
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1780 1773 SD 12.3940 36.5620 7.1060 S.3 111 MET111 -0.1641
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1781 1774 CE 11.7250 34.9420 6.9600 C.3 111 MET111 -0.0181
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1782 1775 H 12.0470 35.7110 11.4690 H 111 MET111 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1783 1776 HA 11.2940 38.5020 10.7690 H 111 MET111 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1784 1777 HB2 10.5660 35.8450 9.3790 H 111 MET111 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1785 1778 HB3 10.4060 37.4780 8.6880 H 111 MET111 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1786 1779 HG2 12.9340 37.7350 9.1700 H 111 MET111 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1787 1780 HG3 12.9490 35.9710 9.4020 H 111 MET111 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1788 1781 HE1 11.6440 34.6750 5.9060 H 111 MET111 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1789 1782 HE2 12.3790 34.2310 7.4650 H 111 MET111 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1790 1783 HE3 10.7370 34.9140 7.4190 H 111 MET111 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1791 1784 N 8.7810 38.3920 10.9230 N.am 112 VAL112 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1792 1785 CA 7.3480 38.4280 11.2530 C.3 112 VAL112 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1793 1786 C 6.5760 38.2510 9.9040 C.2 112 VAL112 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1794 1787 O 6.7510 39.0610 8.9890 O.2 112 VAL112 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1795 1788 CB 6.8800 39.6510 12.0410 C.3 112 VAL112 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1796 1789 CG1 5.3680 39.6750 12.2990 C.3 112 VAL112 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1797 1790 CG2 7.5630 39.6960 13.4010 C.3 112 VAL112 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1798 1791 H 9.1720 39.1580 10.3940 H 112 VAL112 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1799 1792 HA 7.1330 37.6880 12.0240 H 112 VAL112 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1800 1793 HB 7.1310 40.5570 11.4890 H 112 VAL112 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1801 1794 HG11 5.1090 40.5710 12.8630 H 112 VAL112 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1802 1795 HG12 4.8370 39.6790 11.3470 H 112 VAL112 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1803 1796 HG13 5.0820 38.7920 12.8700 H 112 VAL112 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1804 1797 HG21 7.2200 40.5720 13.9510 H 112 VAL112 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1805 1798 HG22 7.3150 38.7950 13.9620 H 112 VAL112 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1806 1799 HG23 8.6430 39.7530 13.2640 H 112 VAL112 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1807 1800 N 5.7010 37.2880 9.8760 N.am 113 TRP113 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1808 1801 CA 4.8700 36.9690 8.6760 C.3 113 TRP113 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1809 1802 C 3.3930 37.0950 9.0610 C.2 113 TRP113 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1810 1803 O 2.9020 36.3740 9.9550 O.2 113 TRP113 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1811 1804 CB 5.1990 35.5670 8.1580 C.3 113 TRP113 0.0013
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1812 1805 CG 6.5300 35.3780 7.4940 C.ar 113 TRP113 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1813 1806 CD1 7.7440 34.9510 8.0160 C.ar 113 TRP113 0.0060
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1814 1807 CD2 6.8060 35.7470 6.1280 C.ar 113 TRP113 0.0029
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1815 1808 NE1 8.7320 34.9790 7.0760 N.ar 113 TRP113 -0.3604
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1816 1809 CE2 8.1800 35.4630 5.8970 C.ar 113 TRP113 0.0467
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1817 1810 CE3 6.0170 36.2630 5.0970 C.ar 113 TRP113 -0.0523
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1818 1811 CZ2 8.7460 35.6850 4.6450 C.ar 113 TRP113 -0.0378
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1819 1812 CZ3 6.6240 36.4540 3.8460 C.ar 113 TRP113 -0.0611
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1820 1813 CH2 7.9650 36.1960 3.6180 C.ar 113 TRP113 -0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1821 1814 H 5.5570 36.7120 10.6930 H 113 TRP113 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1822 1815 HA 5.1380 37.6390 7.8590 H 113 TRP113 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1823 1816 HB2 5.1840 34.8600 8.9870 H 113 TRP113 0.0337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1824 1817 HB3 4.4580 35.2700 7.4150 H 113 TRP113 0.0337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1825 1818 HD1 7.8110 34.6510 9.0510 H 113 TRP113 0.0810
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1826 1819 HE1 9.6650 34.6750 7.3150 H 113 TRP113 0.1653
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1827 1820 HE3 4.9790 36.5000 5.2780 H 113 TRP113 0.0624
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1828 1821 HZ2 9.7890 35.4600 4.4760 H 113 TRP113 0.0638
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1829 1822 HZ3 6.0410 36.8160 3.0120 H 113 TRP113 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1830 1823 HH2 8.4040 36.3890 2.6500 H 113 TRP113 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1831 1824 N 2.6890 37.9520 8.3440 N.am 114 ILE114 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1832 1825 CA 1.2620 38.1910 8.4810 C.3 114 ILE114 0.1020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1833 1826 C 0.6420 37.2310 7.4250 C.2 114 ILE114 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1834 1827 O 0.8740 37.4610 6.2450 O.2 114 ILE114 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1835 1828 CB 0.8130 39.6650 8.2370 C.3 114 ILE114 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1836 1829 CG1 1.2040 40.5080 9.4730 C.3 114 ILE114 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1837 1830 CG2 -0.7540 39.7330 8.0520 C.3 114 ILE114 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1838 1831 CD1 1.7360 41.9020 9.1720 C.3 114 ILE114 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1839 1832 H 3.1420 38.5060 7.6320 H 114 ILE114 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1840 1833 HA 0.9530 37.9740 9.5040 H 114 ILE114 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1841 1834 HB 1.3250 40.0610 7.3600 H 114 ILE114 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1842 1835 HG12 0.3310 40.6430 10.1120 H 114 ILE114 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1843 1836 HG13 1.9860 39.9940 10.0310 H 114 ILE114 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1844 1837 HG21 -1.0560 40.7670 7.8820 H 114 ILE114 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1845 1838 HG22 -1.0460 39.1250 7.1960 H 114 ILE114 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1846 1839 HG23 -1.2430 39.3550 8.9500 H 114 ILE114 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1847 1840 HD11 1.9800 42.4080 10.1060 H 114 ILE114 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1848 1841 HD12 2.6320 41.8240 8.5570 H 114 ILE114 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1849 1842 HD13 0.9770 42.4730 8.6370 H 114 ILE114 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1850 1843 N -0.0570 36.2110 7.8480 N.am 115 VAL115 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1851 1844 CA -0.6430 35.2590 6.8930 C.3 115 VAL115 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1852 1845 C -2.1350 35.3840 6.6430 C.2 115 VAL115 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1853 1846 O -2.6120 34.5470 5.8560 O.2 115 VAL115 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1854 1847 CB -0.1250 33.8630 7.2420 C.3 115 VAL115 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1855 1848 CG1 1.4140 33.8190 7.4340 C.3 115 VAL115 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1856 1849 CG2 -0.7420 33.3960 8.5510 C.3 115 VAL115 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1857 1850 H -0.1980 36.0720 8.8380 H 115 VAL115 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1858 1851 HA -0.0220 35.2120 5.9990 H 115 VAL115 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1859 1852 HB -0.3630 33.1740 6.4320 H 115 VAL115 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1860 1853 HG11 1.7210 32.8020 7.6800 H 115 VAL115 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1861 1854 HG12 1.9050 34.1340 6.5130 H 115 VAL115 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1862 1855 HG13 1.6990 34.4900 8.2440 H 115 VAL115 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1863 1856 HG21 -0.3690 32.4010 8.7940 H 115 VAL115 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1864 1857 HG22 -0.4730 34.0890 9.3480 H 115 VAL115 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1865 1858 HG23 -1.8270 33.3620 8.4500 H 115 VAL115 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1866 1859 N -2.8360 36.3660 7.1920 N.am 116 GLY116 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1867 1860 CA -4.2480 36.5780 6.8490 C.3 116 GLY116 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1868 1861 C -5.0140 36.9120 8.1210 C.2 116 GLY116 0.2306
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1869 1862 O -4.3740 36.8300 9.1950 O.2 116 GLY116 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1870 1863 H -2.4000 36.9860 7.8600 H 116 GLY116 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1871 1864 HA2 -4.3310 37.4020 6.1400 H 116 GLY116 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1872 1865 HA3 -4.6530 35.6710 6.4000 H 116 GLY116 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1873 1866 N -6.2560 37.2830 8.0780 N.am 117 GLY117 -0.3054
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1874 1867 CA -7.0580 37.4550 6.8360 C.3 117 GLY117 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1875 1868 C -7.1580 38.9040 6.4280 C.2 117 GLY117 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1876 1869 O -6.2920 39.7390 6.7150 O.2 117 GLY117 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1877 1870 H -6.7540 37.4800 8.9340 H 117 GLY117 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1878 1871 HA2 -6.5900 36.9030 6.0210 H 117 GLY117 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1879 1872 HA3 -8.0670 37.0760 6.9990 H 117 GLY117 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1880 1873 N -8.2920 39.2350 5.7850 N.am 118 SER118 -0.3008
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1881 1874 CA -8.4870 40.5750 5.2310 C.3 118 SER118 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1882 1875 C -8.2540 41.7570 6.1620 C.2 118 SER118 0.2363
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1883 1876 O -7.5200 42.6810 5.7150 O.2 118 SER118 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1884 1877 CB -9.8510 40.7460 4.5630 C.3 118 SER118 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1885 1878 OG -10.6960 39.9000 5.2790 O.3 118 SER118 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1886 1879 H -9.0290 38.5530 5.6770 H 118 SER118 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1887 1880 HA -7.8980 40.6810 4.3200 H 118 SER118 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1888 1881 HB2 -10.1630 41.7880 4.6340 H 118 SER118 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1889 1882 HB3 -9.7810 40.4590 3.5140 H 118 SER118 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1890 1883 HG -11.5830 39.9510 4.9160 H 118 SER118 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1891 1884 N -8.8300 41.6090 7.3380 N.am 119 SER119 -0.3005
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1892 1885 CA -8.6650 42.7090 8.3250 C.3 119 SER119 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1893 1886 C -7.2410 42.8630 8.8090 C.2 119 SER119 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1894 1887 O -6.8590 44.0190 8.9580 O.2 119 SER119 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1895 1888 CB -9.7260 42.6830 9.4000 C.3 119 SER119 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1896 1889 OG -9.4080 41.9100 10.5290 O.3 119 SER119 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1897 1890 H -9.3590 40.7720 7.5400 H 119 SER119 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1898 1891 HA -9.1780 43.6010 7.9650 H 119 SER119 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1899 1892 HB2 -9.9070 43.6970 9.7570 H 119 SER119 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1900 1893 HB3 -10.6490 42.2720 8.9910 H 119 SER119 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1901 1894 HG -10.1320 41.9490 11.1580 H 119 SER119 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1902 1895 N -6.4910 41.7780 8.9600 N.am 120 VAL120 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1903 1896 CA -5.1010 41.8940 9.4220 C.3 120 VAL120 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1904 1897 C -4.2720 42.5510 8.3400 C.2 120 VAL120 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1905 1898 O -3.4300 43.3770 8.6020 O.2 120 VAL120 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1906 1899 CB -4.6010 40.5170 9.8450 C.3 120 VAL120 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1907 1900 CG1 -3.2140 40.4750 10.4460 C.3 120 VAL120 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1908 1901 CG2 -5.6440 39.9820 10.7940 C.3 120 VAL120 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1909 1902 H -6.8750 40.8660 8.7570 H 120 VAL120 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1910 1903 HA -5.0780 42.4170 10.3780 H 120 VAL120 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1911 1904 HB -4.6520 39.8350 8.9960 H 120 VAL120 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1912 1905 HG11 -2.9630 39.4480 10.7090 H 120 VAL120 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1913 1906 HG12 -2.4920 40.8510 9.7210 H 120 VAL120 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1914 1907 HG13 -3.1860 41.0960 11.3410 H 120 VAL120 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1915 1908 HG21 -5.3480 38.9910 11.1390 H 120 VAL120 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1916 1909 HG22 -5.7350 40.6520 11.6490 H 120 VAL120 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1917 1910 HG23 -6.6030 39.9160 10.2810 H 120 VAL120 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1918 1911 N -4.5200 42.0840 7.1100 N.am 121 TYR121 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1919 1912 CA -3.7900 42.6120 5.9500 C.3 121 TYR121 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1920 1913 C -3.9970 44.1300 5.8850 C.2 121 TYR121 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1921 1914 O -2.9850 44.7730 5.6360 O.2 121 TYR121 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1922 1915 CB -4.2580 42.0020 4.6410 C.3 121 TYR121 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1923 1916 CG -3.8830 40.5550 4.4240 C.ar 121 TYR121 -0.0449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1924 1917 CD1 -4.8350 39.7100 3.8770 C.ar 121 TYR121 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1925 1918 CD2 -2.5780 40.0950 4.6920 C.ar 121 TYR121 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1926 1919 CE1 -4.4980 38.3620 3.5810 C.ar 121 TYR121 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1927 1920 CE2 -2.1970 38.7890 4.3960 C.ar 121 TYR121 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1928 1921 CZ -3.2110 37.9390 3.8760 C.ar 121 TYR121 0.1169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1929 1922 OH -2.8200 36.6920 3.5570 O.3 121 TYR121 -0.5068
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1930 1923 H -5.2140 41.3630 6.9740 H 121 TYR121 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1931 1924 HA -2.7300 42.3810 6.0520 H 121 TYR121 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1932 1925 HB2 -5.3460 42.0480 4.5870 H 121 TYR121 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1933 1926 HB3 -3.8290 42.5580 3.8070 H 121 TYR121 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1934 1927 HD1 -5.8310 40.0760 3.6760 H 121 TYR121 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1935 1928 HD2 -1.8510 40.7600 5.1350 H 121 TYR121 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1936 1929 HE1 -5.2340 37.7050 3.1410 H 121 TYR121 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1937 1930 HE2 -1.1780 38.4720 4.5650 H 121 TYR121 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1938 1931 HH -1.9080 36.5630 3.8280 H 121 TYR121 0.2921
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1939 1932 N -5.2510 44.4840 6.1000 N.am 122 LYS122 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1940 1933 CA -5.5860 45.9520 6.1070 C.3 122 LYS122 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1941 1934 C -4.7760 46.6820 7.1640 C.2 122 LYS122 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1942 1935 O -4.1040 47.7000 6.8860 O.2 122 LYS122 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1943 1936 CB -7.0160 46.1880 6.5360 C.3 122 LYS122 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1944 1937 CG -8.0840 46.2630 5.4520 C.3 122 LYS122 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1945 1938 CD -7.9820 45.1280 4.4430 C.3 122 LYS122 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1946 1939 CE -9.3480 44.9470 3.7680 C.3 122 LYS122 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1947 1940 NZ -10.3430 44.7110 4.8550 N.4 122 LYS122 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1948 1941 H -5.9560 43.7770 6.2540 H 122 LYS122 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1949 1942 HA -5.2690 46.4020 5.1660 H 122 LYS122 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1950 1943 HB2 -7.3370 45.3800 7.1940 H 122 LYS122 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1951 1944 HB3 -7.0850 47.1370 7.0670 H 122 LYS122 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1952 1945 HG2 -9.0720 46.2130 5.9100 H 122 LYS122 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1953 1946 HG3 -7.9840 47.2020 4.9070 H 122 LYS122 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1954 1947 HD2 -7.2290 45.3730 3.6940 H 122 LYS122 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1955 1948 HD3 -7.6980 44.2090 4.9560 H 122 LYS122 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1956 1949 HE2 -9.5980 45.8470 3.2060 H 122 LYS122 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1957 1950 HE3 -9.3090 44.0940 3.0900 H 122 LYS122 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1958 1951 HZ1 -11.2600 44.5860 4.4510 H 122 LYS122 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1959 1952 HZ2 -10.0870 43.8820 5.3720 H 122 LYS122 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1960 1953 HZ3 -10.3560 45.5050 5.4790 H 122 LYS122 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1961 1954 N -4.8490 46.1190 8.3600 N.am 123 GLU123 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1962 1955 CA -4.1630 46.6580 9.5450 C.3 123 GLU123 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1963 1956 C -2.6960 46.9250 9.2030 C.2 123 GLU123 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1964 1957 O -2.1490 48.0180 9.4090 O.2 123 GLU123 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1965 1958 CB -4.0970 45.7550 10.7770 C.3 123 GLU123 -0.0209
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1966 1959 CG -5.0990 45.8720 11.8810 C.3 123 GLU123 -0.0111
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1967 1960 CD -5.0670 45.2090 13.2140 C.2 123 GLU123 0.0418
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1968 1961 OE1 -5.7270 44.2070 13.5350 O.co2 123 GLU123 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1969 1962 OE2 -4.3590 45.7800 14.0640 O.co2 123 GLU123 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1970 1963 H -5.3950 45.2790 8.4900 H 123 GLU123 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1971 1964 HA -4.6160 47.6090 9.8260 H 123 GLU123 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1972 1965 HB2 -4.1850 44.7130 10.4690 H 123 GLU123 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1973 1966 HB3 -3.1450 45.9040 11.2870 H 123 GLU123 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1974 1967 HG2 -5.1740 46.9130 12.1950 H 123 GLU123 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1975 1968 HG3 -6.0710 45.5280 11.5280 H 123 GLU123 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1976 1969 N -2.0800 45.8600 8.6940 N.am 124 ALA124 -0.3027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1977 1970 CA -0.6660 45.9080 8.3400 C.3 124 ALA124 0.0966
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1978 1971 C -0.2760 46.9080 7.2720 C.2 124 ALA124 0.2337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1979 1972 O 0.7720 47.5860 7.4430 O.2 124 ALA124 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1980 1973 CB -0.1740 44.4890 8.0600 C.3 124 ALA124 -0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1981 1974 H -2.5930 45.0020 8.5480 H 124 ALA124 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1982 1975 HA -0.0660 45.9890 9.2470 H 124 ALA124 0.0592
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1983 1976 HB1 0.8830 44.5160 7.7940 H 124 ALA124 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1984 1977 HB2 -0.3090 43.8750 8.9500 H 124 ALA124 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1985 1978 HB3 -0.7450 44.0620 7.2350 H 124 ALA124 0.0252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1986 1979 N -0.9930 47.0460 6.1820 N.am 125 MET125 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1987 1980 CA -0.6300 47.9230 5.0660 C.3 125 MET125 0.1002
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1988 1981 C -0.6060 49.4300 5.2720 C.2 125 MET125 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1989 1982 O -0.0950 50.2770 4.5270 O.2 125 MET125 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1990 1983 CB -1.7160 47.7520 4.0070 C.3 125 MET125 -0.0169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1991 1984 CG -1.2400 46.8240 2.9120 C.3 125 MET125 -0.0044
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1992 1985 SD -2.8380 46.5470 2.0300 S.3 125 MET125 -0.1641
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1993 1986 CE -2.5070 44.9180 1.3680 C.3 125 MET125 -0.0181
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1994 1987 H -1.8540 46.5290 6.0750 H 125 MET125 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1995 1988 HA 0.4060 47.7400 4.7820 H 125 MET125 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1996 1989 HB2 -2.6100 47.3300 4.4670 H 125 MET125 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1997 1990 HB3 -1.9560 48.7220 3.5720 H 125 MET125 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1998 1991 HG2 -0.4810 47.3270 2.3130 H 125 MET125 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
1999 1992 HG3 -0.8140 45.9250 3.3570 H 125 MET125 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2000 1993 HE1 -3.3690 44.5760 0.7960 H 125 MET125 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2001 1994 HE2 -1.6330 44.9600 0.7180 H 125 MET125 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2002 1995 HE3 -2.3170 44.2240 2.1870 H 125 MET125 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2003 1996 N -1.2780 49.7260 6.3320 N.am 126 ASN126 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2004 1997 CA -1.5950 51.0760 6.8430 C.3 126 ASN126 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2005 1998 C -0.8570 51.2110 8.1530 C.2 126 ASN126 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2006 1999 O -1.3050 51.9120 9.0630 O.2 126 ASN126 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2007 2000 CB -3.0830 50.8060 6.7780 C.3 126 ASN126 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2008 2001 CG -4.2560 51.6320 7.0880 C.2 126 ASN126 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2009 2002 OD1 -4.2270 52.8680 6.8970 O.2 126 ASN126 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2010 2003 ND2 -5.2930 50.9250 7.5530 N.am 126 ASN126 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2011 2004 H -1.6520 48.9910 6.9140 H 126 ASN126 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2012 2005 HA -1.3330 51.8200 6.0910 H 126 ASN126 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2013 2006 HB2 -3.3630 50.5570 5.7550 H 126 ASN126 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2014 2007 HB3 -3.3310 49.9720 7.4350 H 126 ASN126 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2015 2008 HD22 -6.1540 51.3930 7.7990 H 126 ASN126 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2016 2009 HD21 -5.2150 49.9240 7.6580 H 126 ASN126 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2017 2010 N 0.2460 50.5020 8.2550 N.am 127 HIS127 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2018 2011 CA 1.1210 50.4650 9.4430 C.3 127 HIS127 0.1050
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2019 2012 C 2.4470 51.0620 8.9650 C.2 127 HIS127 0.2369
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2020 2013 O 2.9060 50.7660 7.8590 O.2 127 HIS127 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2021 2014 CB 1.3280 49.0890 10.0860 C.3 127 HIS127 0.0160
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2022 2015 CG 2.3480 49.0490 11.1830 C.ar 127 HIS127 0.0375
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2023 2016 ND1 2.0220 49.0510 12.5270 N.ar 127 HIS127 -0.3481
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2024 2017 CD2 3.6980 49.0100 11.1080 C.ar 127 HIS127 0.0485
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2025 2018 CE1 3.1480 48.9970 13.2290 C.ar 127 HIS127 0.0935
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2026 2019 NE2 4.1730 48.9890 12.3970 N.ar 127 HIS127 -0.2440
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2027 2020 H 0.5500 49.9270 7.4820 H 127 HIS127 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2028 2021 HA 0.6480 51.0100 10.2600 H 127 HIS127 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2029 2022 HB2 0.3890 48.7460 10.5210 H 127 HIS127 0.0351
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2030 2023 HB3 1.6580 48.3790 9.3280 H 127 HIS127 0.0351
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2031 2024 HD1 1.0540 49.0900 12.8120 H 127 HIS127 0.1665
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2032 2025 HD2 4.1850 49.0010 10.1440 H 127 HIS127 0.0848
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2033 2026 HE1 3.1110 48.9680 14.3080 H 127 HIS127 0.1027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2034 2027 N 2.9710 51.9400 9.8040 N.am 128 PRO128 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2035 2028 CA 4.2080 52.6630 9.4800 C.3 128 PRO128 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2036 2029 C 5.4040 51.7470 9.3510 C.2 128 PRO128 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2037 2030 O 5.5120 50.7950 10.1310 O.2 128 PRO128 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2038 2031 CB 4.3270 53.6650 10.6460 C.3 128 PRO128 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2039 2032 CG 3.7040 52.8920 11.8000 C.3 128 PRO128 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2040 2033 CD 2.4430 52.3540 11.1200 C.3 128 PRO128 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2041 2034 HA 4.0720 53.2200 8.5530 H 128 PRO128 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2042 2035 HB2 5.3770 53.9060 10.8130 H 128 PRO128 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2043 2036 HB3 3.7810 54.5760 10.4000 H 128 PRO128 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2044 2037 HG2 4.3920 52.1140 12.1300 H 128 PRO128 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2045 2038 HG3 3.5020 53.5730 12.6270 H 128 PRO128 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2046 2039 HD3 1.6720 53.1120 10.9810 H 128 PRO128 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2047 2040 HD2 2.0150 51.4900 11.6280 H 128 PRO128 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2048 2041 N 6.2550 52.0750 8.3980 N.am 129 GLY129 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2049 2042 CA 7.4770 51.3010 8.2130 C.3 129 GLY129 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2050 2043 C 7.5430 50.5810 6.8870 C.2 129 GLY129 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2051 2044 O 6.6940 50.6860 5.9980 O.2 129 GLY129 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2052 2045 H 6.0600 52.8620 7.7960 H 129 GLY129 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2053 2046 HA2 8.3400 51.9650 8.2650 H 129 GLY129 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2054 2047 HA3 7.5520 50.5470 8.9960 H 129 GLY129 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2055 2048 N 8.6230 49.8570 6.8200 N.am 130 HIS130 -0.3023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2056 2049 CA 8.9980 49.0530 5.6500 C.3 130 HIS130 0.1047
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2057 2050 C 8.3170 47.6850 5.6820 C.2 130 HIS130 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2058 2051 O 8.7610 46.7570 6.3880 O.2 130 HIS130 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2059 2052 CB 10.5330 48.8730 5.5100 C.3 130 HIS130 0.0160
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2060 2053 CG 10.9630 47.9260 4.4180 C.ar 130 HIS130 0.0375
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2061 2054 ND1 10.9810 48.1970 3.0710 N.ar 130 HIS130 -0.3481
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2062 2055 CD2 11.4370 46.6500 4.5380 C.ar 130 HIS130 0.0485
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2063 2056 CE1 11.4100 47.1410 2.4080 C.ar 130 HIS130 0.0935
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2064 2057 NE2 11.6850 46.1830 3.2660 N.ar 130 HIS130 -0.2440
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2065 2058 H 9.2600 49.8270 7.6030 H 130 HIS130 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2066 2059 HA 8.7570 49.6010 4.7390 H 130 HIS130 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2067 2060 HB2 10.9940 49.8360 5.2890 H 130 HIS130 0.0351
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2068 2061 HB3 10.9400 48.4820 6.4420 H 130 HIS130 0.0351
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2069 2062 HD1 10.6890 49.1030 2.7340 H 130 HIS130 0.1665
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2070 2063 HD2 11.5490 46.2050 5.5160 H 130 HIS130 0.0848
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2071 2064 HE1 11.4830 47.1730 1.3310 H 130 HIS130 0.1027
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2072 2065 N 7.3130 47.5180 4.8690 N.am 131 LEU131 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2073 2066 CA 6.5510 46.2940 4.6860 C.3 131 LEU131 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2074 2067 C 6.7770 45.6230 3.3320 C.2 131 LEU131 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2075 2068 O 6.8120 46.3690 2.3320 O.2 131 LEU131 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2076 2069 CB 5.0680 46.7730 4.7870 C.3 131 LEU131 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2077 2070 CG 4.0620 45.6330 4.5970 C.3 131 LEU131 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2078 2071 CD1 4.2180 44.6200 5.7290 C.3 131 LEU131 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2079 2072 CD2 2.6380 46.1690 4.5870 C.3 131 LEU131 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2080 2073 H 6.9990 48.2840 4.2910 H 131 LEU131 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2081 2074 HA 6.8480 45.5640 5.4390 H 131 LEU131 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2082 2075 HB2 4.8930 47.2110 5.7700 H 131 LEU131 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2083 2076 HB3 4.8740 47.5200 4.0170 H 131 LEU131 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2084 2077 HG 4.2360 45.1500 3.6350 H 131 LEU131 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2085 2078 HD11 3.5020 43.8090 5.5930 H 131 LEU131 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2086 2079 HD12 5.2300 44.2160 5.7190 H 131 LEU131 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2087 2080 HD13 4.0330 45.1110 6.6850 H 131 LEU131 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2088 2081 HD21 1.9390 45.3430 4.4510 H 131 LEU131 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2089 2082 HD22 2.4300 46.6680 5.5340 H 131 LEU131 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2090 2083 HD23 2.5230 46.8800 3.7690 H 131 LEU131 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2091 2084 N 6.8930 44.3170 3.2720 N.am 132 LYS132 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2092 2085 CA 6.9970 43.6290 1.9730 C.3 132 LYS132 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2093 2086 C 5.7170 42.8010 1.8330 C.2 132 LYS132 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2094 2087 O 5.2110 42.3380 2.8760 O.2 132 LYS132 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2095 2088 CB 8.1740 42.6920 1.8710 C.3 132 LYS132 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2096 2089 CG 9.4900 43.5030 1.6560 C.3 132 LYS132 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2097 2090 CD 10.5570 42.3690 1.5490 C.3 132 LYS132 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2098 2091 CE 11.8110 42.8480 2.2760 C.3 132 LYS132 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2099 2092 NZ 11.7720 42.2790 3.6410 N.4 132 LYS132 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2100 2093 H 6.9120 43.7720 4.1220 H 132 LYS132 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2101 2094 HA 7.0540 44.3680 1.1740 H 132 LYS132 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2102 2095 HB2 8.2580 42.1120 2.7900 H 132 LYS132 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2103 2096 HB3 8.0290 42.0160 1.0280 H 132 LYS132 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2104 2097 HG2 9.4070 44.0970 0.7460 H 132 LYS132 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2105 2098 HG3 9.6530 44.1640 2.5070 H 132 LYS132 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2106 2099 HD2 10.1710 41.4610 2.0130 H 132 LYS132 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2107 2100 HD3 10.7770 42.1740 0.4990 H 132 LYS132 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2108 2101 HE2 12.6960 42.5010 1.7420 H 132 LYS132 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2109 2102 HE3 11.8150 43.9370 2.3160 H 132 LYS132 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2110 2103 HZ1 12.5900 42.5760 4.1540 H 132 LYS132 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2111 2104 HZ2 10.9420 42.6010 4.1170 H 132 LYS132 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2112 2105 HZ3 11.7580 41.2710 3.5860 H 132 LYS132 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2113 2106 N 5.2140 42.6670 0.6440 N.am 133 LEU133 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2114 2107 CA 4.0020 41.8890 0.3660 C.3 133 LEU133 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2115 2108 C 4.4590 40.7730 -0.6110 C.2 133 LEU133 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2116 2109 O 4.9500 41.0960 -1.7230 O.2 133 LEU133 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2117 2110 CB 2.9740 42.8130 -0.2820 C.3 133 LEU133 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2118 2111 CG 1.8030 43.4870 0.3850 C.3 133 LEU133 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2119 2112 CD1 2.0910 44.0190 1.7750 C.3 133 LEU133 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2120 2113 CD2 1.2210 44.5440 -0.5320 C.3 133 LEU133 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2121 2114 H 5.6600 43.1110 -0.1460 H 133 LEU133 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2122 2115 HA 3.6210 41.4640 1.2950 H 133 LEU133 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2123 2116 HB2 3.4800 43.6840 -0.6990 H 133 LEU133 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2124 2117 HB3 2.4550 42.2790 -1.0780 H 133 LEU133 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2125 2118 HG 0.9370 42.8250 0.3560 H 133 LEU133 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2126 2119 HD11 1.1930 44.4870 2.1790 H 133 LEU133 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2127 2120 HD12 2.3940 43.1970 2.4240 H 133 LEU133 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2128 2121 HD13 2.8930 44.7560 1.7240 H 133 LEU133 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2129 2122 HD21 0.3750 45.0260 -0.0410 H 133 LEU133 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2130 2123 HD22 1.9830 45.2900 -0.7570 H 133 LEU133 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2131 2124 HD23 0.8860 44.0770 -1.4580 H 133 LEU133 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2132 2125 N 4.3090 39.5710 -0.2290 N.am 134 PHE134 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2133 2126 CA 4.6400 38.3930 -1.0350 C.3 134 PHE134 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2134 2127 C 3.2960 37.9610 -1.5970 C.2 134 PHE134 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2135 2128 O 2.4850 37.4320 -0.8290 O.2 134 PHE134 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2136 2129 CB 5.3240 37.2990 -0.2120 C.3 134 PHE134 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2137 2130 CG 6.7410 37.6990 0.1250 C.ar 134 PHE134 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2138 2131 CD1 6.9990 38.5850 1.1920 C.ar 134 PHE134 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2139 2132 CD2 7.7560 37.1830 -0.6670 C.ar 134 PHE134 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2140 2133 CE1 8.3130 38.9730 1.4420 C.ar 134 PHE134 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2141 2134 CE2 9.1070 37.5710 -0.3940 C.ar 134 PHE134 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2142 2135 CZ 9.3590 38.4300 0.6840 C.ar 134 PHE134 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2143 2136 H 3.9380 39.3760 0.6900 H 134 PHE134 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2144 2137 HA 5.3750 38.6650 -1.7920 H 134 PHE134 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2145 2138 HB2 4.7710 37.1410 0.7140 H 134 PHE134 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2146 2139 HB3 5.3450 36.3720 -0.7850 H 134 PHE134 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2147 2140 HD1 6.1840 38.9510 1.7990 H 134 PHE134 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2148 2141 HD2 7.5200 36.5020 -1.4720 H 134 PHE134 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2149 2142 HE1 8.5250 39.6920 2.2200 H 134 PHE134 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2150 2143 HE2 9.9110 37.2020 -1.0140 H 134 PHE134 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2151 2144 HZ 10.3830 38.6710 0.9260 H 134 PHE134 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2152 2145 N 3.0560 38.1590 -2.8650 N.am 135 VAL135 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2153 2146 CA 1.7680 37.8810 -3.4730 C.3 135 VAL135 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2154 2147 C 1.7550 36.7830 -4.5320 C.2 135 VAL135 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2155 2148 O 2.4980 36.9400 -5.4790 O.2 135 VAL135 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2156 2149 CB 1.2840 39.2560 -4.0400 C.3 135 VAL135 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2157 2150 CG1 -0.1640 39.1110 -4.5680 C.3 135 VAL135 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2158 2151 CG2 1.2580 40.4160 -3.0760 C.3 135 VAL135 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2159 2152 H 3.7830 38.5200 -3.4660 H 135 VAL135 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2160 2153 HA 1.0420 37.6440 -2.6950 H 135 VAL135 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2161 2154 HB 1.9410 39.5660 -4.8530 H 135 VAL135 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2162 2155 HG11 -0.5040 40.0680 -4.9640 H 135 VAL135 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2163 2156 HG12 -0.1900 38.3610 -5.3590 H 135 VAL135 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2164 2157 HG13 -0.8190 38.8020 -3.7540 H 135 VAL135 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2165 2158 HG21 0.9050 41.3090 -3.5910 H 135 VAL135 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2166 2159 HG22 0.5880 40.1860 -2.2480 H 135 VAL135 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2167 2160 HG23 2.2630 40.5920 -2.6920 H 135 VAL135 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2168 2161 N 0.9630 35.7590 -4.4020 N.am 136 THR136 -0.3003
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2169 2162 CA 0.7560 34.6930 -5.3400 C.3 136 THR136 0.1252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2170 2163 C -0.4710 35.1010 -6.1920 C.2 136 THR136 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2171 2164 O -1.5940 35.0400 -5.6840 O.2 136 THR136 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2172 2165 CB 0.5900 33.2580 -4.7400 C.3 136 THR136 0.0792
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2173 2166 OG1 1.7370 33.0110 -3.9010 O.3 136 THR136 -0.3897
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2174 2167 CG2 0.5000 32.1540 -5.8820 C.3 136 THR136 -0.0367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2175 2168 H 0.4070 35.6530 -3.5650 H 136 THR136 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2176 2169 HA 1.6740 34.5190 -5.9010 H 136 THR136 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2177 2170 HB -0.3340 33.2090 -4.1650 H 136 THR136 0.0614
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2178 2171 HG1 1.6680 32.1350 -3.5140 H 136 THR136 0.2099
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2179 2172 HG21 0.3850 31.1700 -5.4280 H 136 THR136 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2180 2173 HG22 -0.3580 32.3610 -6.5210 H 136 THR136 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2181 2174 HG23 1.4110 32.1740 -6.4800 H 136 THR136 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2182 2175 N -0.2560 35.4530 -7.4360 N.am 137 ARG137 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2183 2176 CA -1.4090 35.8340 -8.3220 C.3 137 ARG137 0.0995
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2184 2177 C -1.9760 34.6100 -9.0080 C.2 137 ARG137 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2185 2178 O -1.2800 34.1010 -9.8760 O.2 137 ARG137 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2186 2179 CB -0.8230 36.7350 -9.4360 C.3 137 ARG137 -0.0231
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2187 2180 CG -0.2820 38.0170 -8.8760 C.3 137 ARG137 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2188 2181 CD -1.4730 38.8410 -8.4760 C.3 137 ARG137 0.0646
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2189 2182 NE -0.9970 40.2180 -8.3790 N.pl3 137 ARG137 -0.2787
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2190 2183 CZ -1.7790 41.1560 -7.8810 C.cat 137 ARG137 0.3410
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2191 2184 NH1 -1.2930 42.3610 -7.5730 N.pl3 137 ARG137 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2192 2185 NH2 -3.0570 40.8560 -7.5990 N.pl3 137 ARG137 -0.2919
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2193 2186 H 0.6860 35.4690 -7.8010 H 137 ARG137 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2194 2187 HA -2.2240 36.2220 -7.7110 H 137 ARG137 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2195 2188 HB2 -0.0120 36.2090 -9.9400 H 137 ARG137 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2196 2189 HB3 -1.6040 36.9760 -10.1580 H 137 ARG137 0.0289
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2197 2190 HG2 0.3490 37.8000 -8.0140 H 137 ARG137 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2198 2191 HG3 0.3070 38.5270 -9.6380 H 137 ARG137 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2199 2192 HD2 -2.2520 38.7470 -9.2330 H 137 ARG137 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2200 2193 HD3 -1.8540 38.4880 -7.5180 H 137 ARG137 0.0655
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2201 2194 HE -0.0660 40.4510 -8.6940 H 137 ARG137 0.2578
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2202 2195 HH12 -1.9040 43.0700 -7.1920 H 137 ARG137 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2203 2196 HH11 -0.3150 42.5640 -7.7210 H 137 ARG137 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2204 2197 HH22 -3.6690 41.5630 -7.2170 H 137 ARG137 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2205 2198 HH21 -3.4060 39.9240 -7.7690 H 137 ARG137 0.2545
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2206 2199 N -3.1460 34.0770 -8.6550 N.am 138 ILE138 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2207 2200 CA -3.7460 32.8970 -9.2970 C.3 138 ILE138 0.1020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2208 2201 C -4.5190 33.4400 -10.4990 C.2 138 ILE138 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2209 2202 O -5.3850 34.2680 -10.2110 O.2 138 ILE138 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2210 2203 CB -4.6180 32.1910 -8.2240 C.3 138 ILE138 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2211 2204 CG1 -3.5740 31.6970 -7.1740 C.3 138 ILE138 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2212 2205 CG2 -5.5250 31.1160 -8.8800 C.3 138 ILE138 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2213 2206 CD1 -4.1010 31.0690 -5.8980 C.3 138 ILE138 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2214 2207 H -3.6800 34.4860 -7.9020 H 138 ILE138 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2215 2208 HA -2.9610 32.1890 -9.5630 H 138 ILE138 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2216 2209 HB -5.3960 32.8730 -7.8810 H 138 ILE138 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2217 2210 HG12 -2.9360 30.9360 -7.6250 H 138 ILE138 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2218 2211 HG13 -2.9610 32.5370 -6.8470 H 138 ILE138 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2219 2212 HG21 -6.1290 30.6320 -8.1120 H 138 ILE138 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2220 2213 HG22 -6.1800 31.5900 -9.6120 H 138 ILE138 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2221 2214 HG23 -4.9040 30.3710 -9.3770 H 138 ILE138 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2222 2215 HD11 -3.2640 30.7740 -5.2650 H 138 ILE138 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2223 2216 HD12 -4.7210 31.7910 -5.3670 H 138 ILE138 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2224 2217 HD13 -4.6970 30.1900 -6.1440 H 138 ILE138 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2225 2218 N -4.0560 33.0970 -11.6920 N.am 139 MET139 -0.3024
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2226 2219 CA -4.6900 33.7200 -12.9140 C.3 139 MET139 0.1002
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2227 2220 C -5.9890 33.1170 -13.3780 C.2 139 MET139 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2228 2221 O -6.1760 32.5710 -14.4730 O.2 139 MET139 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2229 2222 CB -3.5300 33.6540 -13.9480 C.3 139 MET139 -0.0169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2230 2223 CG -2.3880 34.5630 -13.4800 C.3 139 MET139 -0.0044
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2231 2224 SD -0.9030 34.2460 -14.5640 S.3 139 MET139 -0.1641
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2232 2225 CE -1.6660 34.3290 -16.1720 C.3 139 MET139 -0.0181
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2233 2226 H -3.2980 32.4340 -11.7680 H 139 MET139 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2234 2227 HA -4.8060 34.7920 -12.7570 H 139 MET139 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2235 2228 HB2 -3.1720 32.6280 -14.0280 H 139 MET139 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2236 2229 HB3 -3.8900 33.9890 -14.9210 H 139 MET139 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2237 2230 HG2 -2.6950 35.6050 -13.5640 H 139 MET139 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2238 2231 HG3 -2.1460 34.3380 -12.4410 H 139 MET139 0.0377
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2239 2232 HE1 -0.9130 34.1600 -16.9410 H 139 MET139 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2240 2233 HE2 -2.4390 33.5650 -16.2480 H 139 MET139 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2241 2234 HE3 -2.1130 35.3130 -16.3120 H 139 MET139 0.0340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2242 2235 N -7.0200 33.2260 -12.5660 N.am 140 GLN140 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2243 2236 CA -8.3710 32.7370 -12.7900 C.3 140 GLN140 0.0999
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2244 2237 C -9.2340 33.4010 -11.6740 C.2 140 GLN140 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2245 2238 O -8.7680 33.7100 -10.5940 O.2 140 GLN140 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2246 2239 CB -8.5590 31.2490 -12.6560 C.3 140 GLN140 -0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2247 2240 CG -8.1560 30.3420 -13.7810 C.3 140 GLN140 0.0259
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2248 2241 CD -8.6160 28.9000 -13.5880 C.2 140 GLN140 0.2106
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2249 2242 OE1 -9.5880 28.5510 -12.9560 O.2 140 GLN140 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2250 2243 NE2 -7.7850 28.0530 -14.1850 N.am 140 GLN140 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2251 2244 H -6.9150 33.6920 -11.6760 H 140 GLN140 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2252 2245 HA -8.7210 33.0710 -13.7670 H 140 GLN140 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2253 2246 HB2 -7.9850 30.8850 -11.8040 H 140 GLN140 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2254 2247 HB3 -9.6150 31.0280 -12.5030 H 140 GLN140 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2255 2248 HG2 -8.5910 30.7030 -14.7130 H 140 GLN140 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2256 2249 HG3 -7.0700 30.3310 -13.8680 H 140 GLN140 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2257 2250 HE22 -7.9610 27.0590 -14.1430 H 140 GLN140 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2258 2251 HE21 -6.9780 28.4030 -14.6810 H 140 GLN140 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2259 2252 N -10.4890 33.5080 -12.0620 N.am 141 ASP141 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2260 2253 CA -11.5050 34.0480 -11.1890 C.3 141 ASP141 0.1045
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2261 2254 C -12.0750 32.8770 -10.3640 C.2 141 ASP141 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2262 2255 O -12.3450 31.7810 -10.9130 O.2 141 ASP141 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2263 2256 CB -12.7060 34.6860 -11.9090 C.3 141 ASP141 0.0138
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2264 2257 CG -12.3620 36.0030 -12.5260 C.2 141 ASP141 0.0440
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2265 2258 OD1 -13.0650 36.3360 -13.5040 O.co2 141 ASP141 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2266 2259 OD2 -11.3840 36.6580 -12.1670 O.co2 141 ASP141 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2267 2260 H -10.7580 33.2090 -12.9880 H 141 ASP141 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2268 2261 HA -11.0530 34.7670 -10.5060 H 141 ASP141 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2269 2262 HB2 -13.0500 34.0210 -12.7020 H 141 ASP141 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2270 2263 HB3 -13.5140 34.8480 -11.1950 H 141 ASP141 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2271 2264 N -12.3830 33.2070 -9.0890 N.am 142 PHE142 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2272 2265 CA -13.0040 32.1590 -8.2710 C.3 142 PHE142 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2273 2266 C -14.0250 32.8130 -7.3080 C.2 142 PHE142 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2274 2267 O -13.6910 33.8780 -6.7670 O.2 142 PHE142 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2275 2268 CB -12.0720 31.2340 -7.4390 C.3 142 PHE142 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2276 2269 CG -11.1020 30.3620 -8.1510 C.ar 142 PHE142 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2277 2270 CD1 -11.4740 29.0300 -8.4340 C.ar 142 PHE142 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2278 2271 CD2 -9.8630 30.8500 -8.5820 C.ar 142 PHE142 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2279 2272 CE1 -10.6840 28.1550 -9.1440 C.ar 142 PHE142 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2280 2273 CE2 -9.0370 29.9390 -9.2750 C.ar 142 PHE142 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2281 2274 CZ -9.4230 28.6310 -9.5390 C.ar 142 PHE142 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2282 2275 H -12.1840 34.1360 -8.7460 H 142 PHE142 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2283 2276 HA -13.4540 31.4090 -8.9210 H 142 PHE142 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2284 2277 HB2 -11.4570 31.8400 -6.7740 H 142 PHE142 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2285 2278 HB3 -12.6760 30.5450 -6.8480 H 142 PHE142 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2286 2279 HD1 -12.4230 28.6490 -8.0880 H 142 PHE142 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2287 2280 HD2 -9.5850 31.8740 -8.3790 H 142 PHE142 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2288 2281 HE1 -11.0450 27.1620 -9.3690 H 142 PHE142 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2289 2282 HE2 -8.0630 30.2500 -9.6230 H 142 PHE142 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2290 2283 HZ -8.7370 27.9770 -10.0560 H 142 PHE142 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2291 2284 N -15.1430 32.1700 -7.1560 N.am 143 GLU143 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2292 2285 CA -16.1630 32.6960 -6.1960 C.3 143 GLU143 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2293 2286 C -15.5370 32.7430 -4.8160 C.2 143 GLU143 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2294 2287 O -14.9780 31.7010 -4.3890 O.2 143 GLU143 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2295 2288 CB -17.3630 31.7380 -6.1890 C.3 143 GLU143 -0.0209
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2296 2289 CG -18.7540 32.3410 -6.1960 C.3 143 GLU143 -0.0111
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2297 2290 CD -19.8280 31.3980 -6.6980 C.2 143 GLU143 0.0418
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2298 2291 OE1 -20.5110 31.4860 -7.6850 O.co2 143 GLU143 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2299 2292 OE2 -19.8970 30.4290 -5.9360 O.co2 143 GLU143 -0.5498
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2300 2293 H -15.3160 31.3260 -7.6830 H 143 GLU143 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2301 2294 HA -16.4560 33.7030 -6.4920 H 143 GLU143 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2302 2295 HB2 -17.3260 31.1020 -7.0730 H 143 GLU143 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2303 2296 HB3 -17.3280 31.1170 -5.2940 H 143 GLU143 0.0291
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2304 2297 HG2 -19.0290 32.6330 -5.1830 H 143 GLU143 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2305 2298 HG3 -18.7670 33.2180 -6.8430 H 143 GLU143 0.0325
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2306 2299 N -15.6010 33.9070 -4.1680 N.am 144 SER144 -0.3006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2307 2300 CA -14.9730 34.0710 -2.8400 C.3 144 SER144 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2308 2301 C -15.8680 34.8270 -1.8530 C.2 144 SER144 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2309 2302 O -16.8630 35.4190 -2.2910 O.2 144 SER144 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2310 2303 CB -13.6920 34.9520 -3.0960 C.3 144 SER144 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2311 2304 OG -12.8000 34.1520 -3.8380 O.3 144 SER144 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2312 2305 H -16.0830 34.6910 -4.5840 H 144 SER144 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2313 2306 HA -14.8090 33.0910 -2.3920 H 144 SER144 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2314 2307 HB2 -13.9710 35.8460 -3.6540 H 144 SER144 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2315 2308 HB3 -13.2530 35.2420 -2.1410 H 144 SER144 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2316 2309 HG -11.9990 34.6490 -4.0200 H 144 SER144 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2317 2310 N -15.5420 34.7320 -0.5630 N.am 145 ASP145 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2318 2311 CA -16.3740 35.4950 0.4020 C.3 145 ASP145 0.1052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2319 2312 C -15.4300 36.3070 1.3060 C.2 145 ASP145 0.2344
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2320 2313 O -15.9260 37.0170 2.1710 O.2 145 ASP145 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2321 2314 CB -17.4060 34.6720 1.1420 C.3 145 ASP145 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2322 2315 CG -16.7400 33.5570 1.9160 C.2 145 ASP145 0.0893
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2323 2316 OD1 -15.6110 33.6540 2.3490 O.co2 145 ASP145 -0.3089
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2324 2317 OD2 -17.3840 32.5530 2.1120 O.co2 145 ASP145 -0.8475
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2325 2318 H -14.7590 34.1600 -0.2810 H 145 ASP145 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2326 2319 HA -17.1520 36.0360 -0.1370 H 145 ASP145 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2327 2320 HB2 -17.9490 35.3100 1.8390 H 145 ASP145 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2328 2321 HB3 -18.1050 34.2380 0.4280 H 145 ASP145 0.0356
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2329 2322 N -14.1530 36.2570 1.0550 N.am 146 THR146 -0.3003
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2330 2323 CA -13.1030 36.9620 1.7270 C.3 146 THR146 0.1252
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2331 2324 C -12.1080 37.5460 0.6990 C.2 146 THR146 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2332 2325 O -11.7940 36.6590 -0.0740 O.2 146 THR146 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2333 2326 CB -12.2220 36.1860 2.7860 C.3 146 THR146 0.0792
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2334 2327 OG1 -13.0560 35.2510 3.4510 O.3 146 THR146 -0.3897
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2335 2328 CG2 -11.7740 37.3740 3.6850 C.3 146 THR146 -0.0367
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2336 2329 H -13.8070 35.6690 0.3100 H 146 THR146 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2337 2330 HA -13.5320 37.7510 2.3440 H 146 THR146 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2338 2331 HB -11.4200 35.6550 2.2730 H 146 THR146 0.0614
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2339 2332 HG1 -12.5410 34.7670 4.1000 H 146 THR146 0.2099
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2340 2333 HG21 -11.1400 37.0020 4.4900 H 146 THR146 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2341 2334 HG22 -11.2160 38.0930 3.0860 H 146 THR146 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2342 2335 HG23 -12.6520 37.8600 4.1100 H 146 THR146 0.0255
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2343 2336 N -11.7250 38.8050 0.8890 N.am 147 PHE147 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2344 2337 CA -10.8530 39.3480 -0.1890 C.3 147 PHE147 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2345 2338 C -9.6340 40.0760 0.3500 C.2 147 PHE147 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2346 2339 O -9.6030 40.4740 1.5040 O.2 147 PHE147 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2347 2340 CB -11.7280 40.3560 -0.9870 C.3 147 PHE147 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2348 2341 CG -12.8570 39.7010 -1.6900 C.ar 147 PHE147 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2349 2342 CD1 -14.0620 39.4010 -1.0170 C.ar 147 PHE147 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2350 2343 CD2 -12.7420 39.3490 -3.0330 C.ar 147 PHE147 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2351 2344 CE1 -15.0620 38.6920 -1.6700 C.ar 147 PHE147 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2352 2345 CE2 -13.7680 38.6920 -3.7340 C.ar 147 PHE147 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2353 2346 CZ -14.9310 38.3300 -2.9980 C.ar 147 PHE147 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2354 2347 H -12.0280 39.3060 1.7120 H 147 PHE147 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2355 2348 HA -10.4880 38.5290 -0.8090 H 147 PHE147 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2356 2349 HB2 -12.1440 41.0960 -0.3040 H 147 PHE147 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2357 2350 HB3 -11.1140 40.8570 -1.7360 H 147 PHE147 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2358 2351 HD1 -14.2050 39.7230 0.0040 H 147 PHE147 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2359 2352 HD2 -11.8380 39.5800 -3.5760 H 147 PHE147 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2360 2353 HE1 -15.9610 38.4140 -1.1400 H 147 PHE147 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2361 2354 HE2 -13.6540 38.4820 -4.7870 H 147 PHE147 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2362 2355 HZ -15.7150 37.7680 -3.4840 H 147 PHE147 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2363 2356 N -8.6620 40.2630 -0.4980 N.am 148 PHE148 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2364 2357 CA -7.4470 41.0330 -0.2380 C.3 148 PHE148 0.1036
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2365 2358 C -7.7250 42.4500 -0.7570 C.2 148 PHE148 0.2368
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2366 2359 O -8.2530 42.5830 -1.8620 O.2 148 PHE148 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2367 2360 CB -6.2540 40.4430 -0.9640 C.3 148 PHE148 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2368 2361 CG -4.9080 41.0140 -0.6140 C.ar 148 PHE148 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2369 2362 CD1 -4.3370 40.7690 0.6320 C.ar 148 PHE148 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2370 2363 CD2 -4.2610 41.7640 -1.5870 C.ar 148 PHE148 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2371 2364 CE1 -3.0850 41.2990 0.9320 C.ar 148 PHE148 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2372 2365 CE2 -2.9850 42.2920 -1.3260 C.ar 148 PHE148 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2373 2366 CZ -2.4200 42.0520 -0.0710 C.ar 148 PHE148 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2374 2367 H -8.7140 39.8590 -1.4220 H 148 PHE148 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2375 2368 HA -7.2480 41.0470 0.8340 H 148 PHE148 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2376 2369 HB2 -6.1900 39.3760 -0.7510 H 148 PHE148 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2377 2370 HB3 -6.3710 40.5920 -2.0370 H 148 PHE148 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2378 2371 HD1 -4.8650 40.1710 1.3600 H 148 PHE148 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2379 2372 HD2 -4.7380 41.9400 -2.5400 H 148 PHE148 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2380 2373 HE1 -2.6470 41.1320 1.9050 H 148 PHE148 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2381 2374 HE2 -2.4720 42.8640 -2.0850 H 148 PHE148 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2382 2375 HZ -1.4400 42.4630 0.1230 H 148 PHE148 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2383 2376 N -7.2870 43.4630 -0.0300 N.am 149 PRO149 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2384 2377 CA -7.4870 44.8510 -0.5060 C.3 149 PRO149 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2385 2378 C -6.6590 45.1380 -1.7330 C.2 149 PRO149 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2386 2379 O -5.6330 44.5110 -2.0860 O.2 149 PRO149 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2387 2380 CB -7.1920 45.6610 0.7510 C.3 149 PRO149 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2388 2381 CG -6.2020 44.8300 1.5390 C.3 149 PRO149 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2389 2382 CD -6.6270 43.3690 1.2860 C.3 149 PRO149 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2390 2383 HA -8.5520 45.0370 -0.6480 H 149 PRO149 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2391 2384 HB2 -6.7700 46.6260 0.4710 H 149 PRO149 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2392 2385 HB3 -8.1160 45.8170 1.3080 H 149 PRO149 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2393 2386 HG2 -5.1930 45.0260 1.1770 H 149 PRO149 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2394 2387 HG3 -6.2660 45.0930 2.5950 H 149 PRO149 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2395 2388 HD3 -7.3380 42.9980 2.0240 H 149 PRO149 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2396 2389 HD2 -5.7810 42.6840 1.2210 H 149 PRO149 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2397 2390 N -7.0820 46.1300 -2.5110 N.am 150 GLU150 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2398 2391 CA -6.3090 46.5250 -3.7130 C.3 150 GLU150 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2399 2392 C -4.9560 47.0650 -3.2220 C.2 150 GLU150 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2400 2393 O -4.9040 47.5770 -2.0880 O.2 150 GLU150 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2401 2394 CB -6.9080 47.7160 -4.4380 C.3 150 GLU150 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2402 2395 CG -8.0710 47.5390 -5.4030 C.3 150 GLU150 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2403 2396 CD -8.3850 48.8790 -6.0670 C.2 150 GLU150 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2404 2397 OE1 -8.3370 49.9200 -5.4040 O.co2 150 GLU150 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2405 2398 OE2 -8.6310 48.6820 -7.2840 O.co2 150 GLU150 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2406 2399 H -7.9360 46.6200 -2.2850 H 150 GLU150 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2407 2400 HA -6.0530 45.6360 -4.2900 H 150 GLU150 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2408 2401 HB2 -7.2890 48.4310 -3.7090 H 150 GLU150 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2409 2402 HB3 -6.1420 48.1930 -5.0490 H 150 GLU150 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2410 2403 HG2 -7.8030 46.8080 -6.1660 H 150 GLU150 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2411 2404 HG3 -8.9470 47.1890 -4.8570 H 150 GLU150 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2412 2405 N -3.9370 46.9240 -4.0560 N.am 151 ILE151 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2413 2406 CA -2.5950 47.4240 -3.6800 C.3 151 ILE151 0.1020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2414 2407 C -2.3760 48.7590 -4.4110 C.2 151 ILE151 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2415 2408 O -2.3750 48.6380 -5.6600 O.2 151 ILE151 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2416 2409 CB -1.4480 46.4390 -4.1300 C.3 151 ILE151 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2417 2410 CG1 -1.5220 45.1480 -3.2570 C.3 151 ILE151 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2418 2411 CG2 -0.0260 47.0300 -4.1110 C.3 151 ILE151 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2419 2412 CD1 -1.1290 43.8990 -4.0570 C.3 151 ILE151 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2420 2413 H -4.0750 46.4750 -4.9500 H 151 ILE151 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2421 2414 HA -2.5610 47.6020 -2.6050 H 151 ILE151 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2422 2415 HB -1.5270 46.2540 -5.2010 H 151 ILE151 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2423 2416 HG12 -0.8410 45.2410 -2.4110 H 151 ILE151 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2424 2417 HG13 -2.5400 45.0140 -2.8910 H 151 ILE151 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2425 2418 HG21 0.6870 46.2730 -4.4370 H 151 ILE151 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2426 2419 HG22 0.0210 47.8860 -4.7840 H 151 ILE151 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2427 2420 HG23 0.2220 47.3500 -3.0990 H 151 ILE151 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2428 2421 HD11 -1.1930 43.0210 -3.4150 H 151 ILE151 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2429 2422 HD12 -1.8070 43.7800 -4.9030 H 151 ILE151 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2430 2423 HD13 -0.1080 44.0080 -4.4230 H 151 ILE151 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2431 2424 N -2.1750 49.8360 -3.7110 N.am 152 ASP152 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2432 2425 CA -1.9020 51.1420 -4.3870 C.3 152 ASP152 0.1045
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2433 2426 C -0.5650 50.8620 -5.1150 C.2 152 ASP152 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2434 2427 O 0.4200 50.7160 -4.3680 O.2 152 ASP152 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2435 2428 CB -1.7540 52.2570 -3.3890 C.3 152 ASP152 0.0138
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2436 2429 CG -2.0120 53.6560 -3.9390 C.2 152 ASP152 0.0440
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2437 2430 OD1 -2.5630 53.7710 -5.0570 O.co2 152 ASP152 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2438 2431 OD2 -1.6500 54.5650 -3.1560 O.co2 152 ASP152 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2439 2432 H -2.2030 49.7950 -2.7020 H 152 ASP152 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2440 2433 HA -2.7080 51.3650 -5.0870 H 152 ASP152 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2441 2434 HB2 -2.4590 52.1090 -2.5710 H 152 ASP152 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2442 2435 HB3 -0.7380 52.2600 -2.9950 H 152 ASP152 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2443 2436 N -0.6510 50.7720 -6.4150 N.am 153 LEU153 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2444 2437 CA 0.4930 50.4280 -7.2530 C.3 153 LEU153 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2445 2438 C 1.4100 51.6310 -7.3200 C.2 153 LEU153 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2446 2439 O 2.6220 51.5540 -7.5980 O.2 153 LEU153 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2447 2440 CB -0.0440 49.9180 -8.5810 C.3 153 LEU153 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2448 2441 CG -0.0200 48.4030 -8.6920 C.3 153 LEU153 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2449 2442 CD1 -0.0600 48.0080 -10.1650 C.3 153 LEU153 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2450 2443 CD2 1.2600 47.9040 -8.0100 C.3 153 LEU153 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2451 2444 H -1.5330 50.9430 -6.8760 H 153 LEU153 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2452 2445 HA 0.9540 49.5120 -6.8820 H 153 LEU153 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2453 2446 HB2 -1.0780 50.2410 -8.7040 H 153 LEU153 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2454 2447 HB3 0.5600 50.3180 -9.3950 H 153 LEU153 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2455 2448 HG -0.8740 47.9860 -8.1590 H 153 LEU153 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2456 2449 HD11 -0.0430 46.9220 -10.2510 H 153 LEU153 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2457 2450 HD12 -0.9720 48.3940 -10.6210 H 153 LEU153 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2458 2451 HD13 0.8060 48.4260 -10.6770 H 153 LEU153 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2459 2452 HD21 1.3060 46.8170 -8.0730 H 153 LEU153 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2460 2453 HD22 2.1290 48.3340 -8.5080 H 153 LEU153 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2461 2454 HD23 1.2560 48.2060 -6.9630 H 153 LEU153 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2462 2455 N 0.7290 52.7350 -7.0300 N.am 154 GLU154 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2463 2456 CA 1.5560 53.9520 -7.0400 C.3 154 GLU154 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2464 2457 C 2.4260 53.8560 -5.7850 C.2 154 GLU154 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2465 2458 O 3.6550 54.0650 -5.8560 O.2 154 GLU154 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2466 2459 CB 0.7680 55.2530 -7.0200 C.3 154 GLU154 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2467 2460 CG -0.0410 55.4930 -8.3100 C.3 154 GLU154 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2468 2461 CD -0.7950 56.7980 -8.2820 C.2 154 GLU154 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2469 2462 OE1 -0.8740 57.4930 -7.2750 O.co2 154 GLU154 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2470 2463 OE2 -1.2980 57.0650 -9.4020 O.co2 154 GLU154 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2471 2464 H -0.2600 52.6810 -6.8310 H 154 GLU154 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2472 2465 HA 2.1540 53.9780 -7.9510 H 154 GLU154 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2473 2466 HB2 0.0640 55.2390 -6.1880 H 154 GLU154 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2474 2467 HB3 1.4540 56.0920 -6.9010 H 154 GLU154 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2475 2468 HG2 0.6350 55.5140 -9.1650 H 154 GLU154 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2476 2469 HG3 -0.7660 54.6890 -8.4400 H 154 GLU154 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2477 2470 N 1.7970 53.5520 -4.6620 N.am 155 LYS155 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2478 2471 CA 2.5410 53.4750 -3.4020 C.3 155 LYS155 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2479 2472 C 3.5300 52.3350 -3.2660 C.2 155 LYS155 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2480 2473 O 4.7440 52.5790 -3.0930 O.2 155 LYS155 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2481 2474 CB 1.6180 53.4740 -2.1910 C.3 155 LYS155 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2482 2475 CG 2.4980 53.2430 -0.9560 C.3 155 LYS155 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2483 2476 CD 1.7040 53.3650 0.3230 C.3 155 LYS155 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2484 2477 CE 0.8670 54.6210 0.4980 C.3 155 LYS155 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2485 2478 NZ -0.2100 54.3310 1.4980 N.4 155 LYS155 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2486 2479 H 0.8030 53.3730 -4.6720 H 155 LYS155 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2487 2480 HA 3.0290 54.4300 -3.2090 H 155 LYS155 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2488 2481 HB2 1.1050 54.4330 -2.1240 H 155 LYS155 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2489 2482 HB3 0.8830 52.6760 -2.2940 H 155 LYS155 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2490 2483 HG2 2.9300 52.2430 -0.9990 H 155 LYS155 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2491 2484 HG3 3.2980 53.9830 -0.9360 H 155 LYS155 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2492 2485 HD2 1.0030 52.5340 0.3970 H 155 LYS155 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2493 2486 HD3 2.3820 53.3440 1.1760 H 155 LYS155 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2494 2487 HE2 1.5000 55.4330 0.8550 H 155 LYS155 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2495 2488 HE3 0.4240 54.8990 -0.4580 H 155 LYS155 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2496 2489 HZ1 -0.7790 55.1550 1.6290 H 155 LYS155 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2497 2490 HZ2 -0.7870 53.5740 1.1620 H 155 LYS155 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2498 2491 HZ3 0.2090 54.0680 2.3790 H 155 LYS155 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2499 2492 N 3.1200 51.0920 -3.2970 N.am 156 TYR156 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2500 2493 CA 4.0180 49.9290 -3.2270 C.3 156 TYR156 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2501 2494 C 4.6890 49.7640 -4.5880 C.2 156 TYR156 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2502 2495 O 4.0130 50.0400 -5.6120 O.2 156 TYR156 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2503 2496 CB 3.2050 48.6120 -3.0620 C.3 156 TYR156 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2504 2497 CG 2.6370 48.5270 -1.6700 C.ar 156 TYR156 -0.0449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2505 2498 CD1 1.4590 49.2100 -1.3630 C.ar 156 TYR156 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2506 2499 CD2 3.2910 47.7930 -0.6810 C.ar 156 TYR156 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2507 2500 CE1 0.9300 49.1390 -0.0780 C.ar 156 TYR156 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2508 2501 CE2 2.7700 47.7130 0.6060 C.ar 156 TYR156 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2509 2502 CZ 1.6040 48.4030 0.8930 C.ar 156 TYR156 0.1169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2510 2503 OH 1.0830 48.3120 2.1580 O.3 156 TYR156 -0.5068
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2511 2504 H 2.1340 50.8870 -3.3730 H 156 TYR156 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2512 2505 HA 4.8440 50.1470 -2.5500 H 156 TYR156 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2513 2506 HB2 2.3880 48.5960 -3.7830 H 156 TYR156 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2514 2507 HB3 3.8590 47.7570 -3.2350 H 156 TYR156 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2515 2508 HD1 0.9590 49.7930 -2.1230 H 156 TYR156 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2516 2509 HD2 4.2130 47.2790 -0.9110 H 156 TYR156 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2517 2510 HE1 0.0080 49.6510 0.1550 H 156 TYR156 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2518 2511 HE2 3.2740 47.1220 1.3570 H 156 TYR156 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2519 2512 HH 1.6610 47.7750 2.7050 H 156 TYR156 0.2921
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2520 2513 N 5.8950 49.2980 -4.5360 N.am 157 LYS157 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2521 2514 CA 6.6690 49.0460 -5.7680 C.3 157 LYS157 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2522 2515 C 6.9380 47.5620 -5.8950 C.2 157 LYS157 0.2339
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2523 2516 O 7.2290 46.8870 -4.8960 O.2 157 LYS157 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2524 2517 CB 7.9730 49.8430 -5.7590 C.3 157 LYS157 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2525 2518 CG 9.1790 49.0290 -6.2050 C.3 157 LYS157 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2526 2519 CD 10.3660 49.8630 -6.6540 C.3 157 LYS157 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2527 2520 CE 11.3820 48.9610 -7.3910 C.3 157 LYS157 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2528 2521 NZ 12.3180 48.3330 -6.4030 N.4 157 LYS157 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2529 2522 H 6.3220 49.1000 -3.6420 H 157 LYS157 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2530 2523 HA 6.1210 49.4320 -6.6270 H 157 LYS157 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2531 2524 HB2 7.8840 50.6940 -6.4340 H 157 LYS157 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2532 2525 HB3 8.1740 50.2010 -4.7490 H 157 LYS157 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2533 2526 HG2 9.5220 48.4050 -5.3800 H 157 LYS157 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2534 2527 HG3 8.8990 48.3950 -7.0460 H 157 LYS157 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2535 2528 HD2 10.0240 50.6490 -7.3270 H 157 LYS157 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2536 2529 HD3 10.8450 50.3130 -5.7840 H 157 LYS157 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2537 2530 HE2 10.8490 48.1770 -7.9290 H 157 LYS157 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2538 2531 HE3 11.9550 49.5610 -8.0980 H 157 LYS157 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2539 2532 HZ1 12.9790 47.7450 -6.8910 H 157 LYS157 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2540 2533 HZ2 12.8160 49.0560 -5.9040 H 157 LYS157 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2541 2534 HZ3 11.7910 47.7740 -5.7480 H 157 LYS157 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2542 2535 N 6.8650 47.0950 -7.1320 N.am 158 LEU158 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2543 2536 CA 7.1200 45.7120 -7.4980 C.3 158 LEU158 0.0996
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2544 2537 C 8.6030 45.4220 -7.6690 C.2 158 LEU158 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2545 2538 O 9.2130 46.1190 -8.5310 O.2 158 LEU158 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2546 2539 CB 6.2940 45.4760 -8.7560 C.3 158 LEU158 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2547 2540 CG 6.3150 44.0520 -9.2940 C.3 158 LEU158 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2548 2541 CD1 5.6490 43.0960 -8.3310 C.3 158 LEU158 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2549 2542 CD2 5.5820 44.1100 -10.6430 C.3 158 LEU158 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2550 2543 H 6.6190 47.7140 -7.8920 H 158 LEU158 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2551 2544 HA 6.6660 45.0510 -6.7600 H 158 LEU158 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2552 2545 HB2 5.2490 45.7140 -8.5550 H 158 LEU158 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2553 2546 HB3 6.6640 46.1140 -9.5590 H 158 LEU158 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2554 2547 HG 7.3460 43.7440 -9.4680 H 158 LEU158 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2555 2548 HD11 5.6790 42.0870 -8.7410 H 158 LEU158 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2556 2549 HD12 6.1750 43.1150 -7.3770 H 158 LEU158 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2557 2550 HD13 4.6120 43.3960 -8.1800 H 158 LEU158 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2558 2551 HD21 5.5600 43.1150 -11.0880 H 158 LEU158 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2559 2552 HD22 4.5620 44.4610 -10.4880 H 158 LEU158 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2560 2553 HD23 6.1040 44.7950 -11.3110 H 158 LEU158 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2561 2554 N 9.1290 44.4800 -6.9350 N.am 159 LEU159 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2562 2555 CA 10.5400 44.0740 -6.9530 C.3 159 LEU159 0.0999
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2563 2556 C 10.6920 43.0760 -8.0970 C.2 159 LEU159 0.2365
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2564 2557 O 10.0960 42.0090 -8.1210 O.2 159 LEU159 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2565 2558 CB 10.9160 43.6010 -5.5700 C.3 159 LEU159 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2566 2559 CG 11.4510 44.4710 -4.4510 C.3 159 LEU159 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2567 2560 CD1 10.8240 45.8460 -4.4100 C.3 159 LEU159 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2568 2561 CD2 11.2290 43.7610 -3.1150 C.3 159 LEU159 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2569 2562 H 8.5520 43.9630 -6.2870 H 159 LEU159 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2570 2563 HA 11.1730 44.9600 -6.9910 H 159 LEU159 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2571 2564 HB2 10.0440 43.1600 -5.0870 H 159 LEU159 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2572 2565 HB3 11.7060 42.8540 -5.6430 H 159 LEU159 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2573 2566 HG 12.5320 44.5660 -4.5490 H 159 LEU159 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2574 2567 HD11 11.2520 46.4170 -3.5860 H 159 LEU159 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2575 2568 HD12 11.0200 46.3630 -5.3490 H 159 LEU159 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2576 2569 HD13 9.7480 45.7510 -4.2650 H 159 LEU159 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2577 2570 HD21 11.6120 44.3820 -2.3050 H 159 LEU159 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2578 2571 HD22 10.1630 43.5890 -2.9670 H 159 LEU159 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2579 2572 HD23 11.7540 42.8060 -3.1190 H 159 LEU159 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2580 2573 N 11.4860 43.4450 -9.0940 N.am 160 PRO160 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2581 2574 CA 11.7080 42.6060 -10.2710 C.3 160 PRO160 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2582 2575 C 12.2030 41.2510 -9.8610 C.2 160 PRO160 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2583 2576 O 11.8520 40.2930 -10.5350 O.2 160 PRO160 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2584 2577 CB 12.6960 43.3980 -11.1350 C.3 160 PRO160 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2585 2578 CG 12.4170 44.8010 -10.7030 C.3 160 PRO160 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2586 2579 CD 12.2270 44.7240 -9.1820 C.3 160 PRO160 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2587 2580 HA 10.7860 42.5390 -10.8490 H 160 PRO160 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2588 2581 HB2 13.7130 43.0750 -10.9140 H 160 PRO160 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2589 2582 HB3 12.4800 43.2220 -12.1890 H 160 PRO160 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2590 2583 HG2 13.2600 45.4380 -10.9690 H 160 PRO160 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2591 2584 HG3 11.5170 45.1630 -11.2010 H 160 PRO160 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2592 2585 HD3 11.6180 45.5270 -8.7660 H 160 PRO160 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2593 2586 HD2 13.1570 44.6450 -8.6190 H 160 PRO160 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2594 2587 N 13.0030 41.1590 -8.8080 N.am 161 GLU161 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2595 2588 CA 13.4690 39.8300 -8.3360 C.3 161 GLU161 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2596 2589 C 13.7220 39.9250 -6.8280 C.2 161 GLU161 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2597 2590 O 13.8450 41.0340 -6.2780 O.2 161 GLU161 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2598 2591 CB 14.6320 39.1980 -9.0800 C.3 161 GLU161 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2599 2592 CG 15.9370 39.9470 -9.2970 C.3 161 GLU161 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2600 2593 CD 15.7910 41.1090 -10.2640 C.2 161 GLU161 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2601 2594 OE1 16.1320 42.2340 -9.9610 O.co2 161 GLU161 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2602 2595 OE2 15.2650 40.7110 -11.3500 O.co2 161 GLU161 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2603 2596 H 13.2980 41.9950 -8.3230 H 161 GLU161 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2604 2597 HA 12.7730 39.0610 -8.6700 H 161 GLU161 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2605 2598 HB2 14.9480 38.2940 -8.5600 H 161 GLU161 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2606 2599 HB3 14.3210 38.9440 -10.0930 H 161 GLU161 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2607 2600 HG2 16.2900 40.3460 -8.3460 H 161 GLU161 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2608 2601 HG3 16.6840 39.2660 -9.7040 H 161 GLU161 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2609 2602 N 13.7070 38.7870 -6.1970 N.am 162 TYR162 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2610 2603 CA 13.9070 38.7130 -4.7300 C.3 162 TYR162 0.1036
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2611 2604 C 14.4710 37.3280 -4.5870 C.2 162 TYR162 0.2368
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2612 2605 O 14.0150 36.3450 -5.2470 O.2 162 TYR162 -0.2735
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2613 2606 CB 12.5210 39.0320 -4.0530 C.3 162 TYR162 -0.0006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2614 2607 CG 12.8300 39.1910 -2.5610 C.ar 162 TYR162 -0.0449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2615 2608 CD1 13.2650 40.4540 -2.1470 C.ar 162 TYR162 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2616 2609 CD2 12.8210 38.1750 -1.6270 C.ar 162 TYR162 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2617 2610 CE1 13.6560 40.7220 -0.8420 C.ar 162 TYR162 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2618 2611 CE2 13.1970 38.4070 -0.2910 C.ar 162 TYR162 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2619 2612 CZ 13.5750 39.6880 0.0820 C.ar 162 TYR162 0.1169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2620 2613 OH 14.0060 39.9130 1.3730 O.3 162 TYR162 -0.5068
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2621 2614 H 13.5570 37.9290 -6.7070 H 162 TYR162 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2622 2615 HA 14.5300 39.5470 -4.4050 H 162 TYR162 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2623 2616 HB2 12.1110 39.9490 -4.4770 H 162 TYR162 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2624 2617 HB3 11.8300 38.2090 -4.2330 H 162 TYR162 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2625 2618 HD1 13.3070 41.2690 -2.8540 H 162 TYR162 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2626 2619 HD2 12.5210 37.1780 -1.9160 H 162 TYR162 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2627 2620 HE1 14.0080 41.7080 -0.5750 H 162 TYR162 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2628 2621 HE2 13.1880 37.5950 0.4210 H 162 TYR162 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2629 2622 HH 13.8900 39.1150 1.8930 H 162 TYR162 0.2921
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2630 2623 N 15.4390 37.1190 -3.6790 N.am 163 PRO163 -0.2884
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2631 2624 CA 16.0640 35.8230 -3.4610 C.3 163 PRO163 0.1023
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2632 2625 C 15.0220 34.8160 -2.9910 C.2 163 PRO163 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2633 2626 O 14.1620 35.2460 -2.1970 O.2 163 PRO163 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2634 2627 CB 17.1400 36.0580 -2.3890 C.3 163 PRO163 -0.0243
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2635 2628 CG 16.7600 37.3530 -1.7720 C.3 163 PRO163 -0.0350
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2636 2629 CD 16.0460 38.1620 -2.8370 C.3 163 PRO163 0.0156
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2637 2630 HA 16.5120 35.4740 -4.3910 H 163 PRO163 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2638 2631 HB2 17.1210 35.2400 -1.6690 H 163 PRO163 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2639 2632 HB3 18.1210 36.1020 -2.8620 H 163 PRO163 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2640 2633 HG2 16.1020 37.1720 -0.9220 H 163 PRO163 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2641 2634 HG3 17.6570 37.8710 -1.4330 H 163 PRO163 0.0281
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2642 2635 HD3 16.7280 38.7640 -3.4380 H 163 PRO163 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2643 2636 HD2 15.2630 38.8010 -2.4280 H 163 PRO163 0.0465
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2644 2637 N 15.0730 33.6430 -3.5030 N.am 164 GLY164 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2645 2638 CA 14.2680 32.4810 -3.2660 C.3 164 GLY164 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2646 2639 C 12.8650 32.5360 -3.8720 C.2 164 GLY164 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2647 2640 O 12.0070 31.7080 -3.4870 O.2 164 GLY164 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2648 2641 H 15.7730 33.4250 -4.1980 H 164 GLY164 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2649 2642 HA2 14.7590 31.6060 -3.6910 H 164 GLY164 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2650 2643 HA3 14.1400 32.3400 -2.1930 H 164 GLY164 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2651 2644 N 12.6270 33.4820 -4.7430 N.am 165 VAL165 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2652 2645 CA 11.3150 33.6710 -5.4160 C.3 165 VAL165 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2653 2646 C 11.4680 33.4250 -6.9350 C.2 165 VAL165 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2654 2647 O 12.1180 34.2560 -7.5760 O.2 165 VAL165 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2655 2648 CB 10.6670 35.0640 -5.2590 C.3 165 VAL165 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2656 2649 CG1 9.2620 35.1430 -5.8950 C.3 165 VAL165 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2657 2650 CG2 10.5170 35.6100 -3.8480 C.3 165 VAL165 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2658 2651 H 13.3560 34.1350 -4.9910 H 165 VAL165 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2659 2652 HA 10.5880 32.9750 -4.9980 H 165 VAL165 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2660 2653 HB 11.3230 35.8210 -5.6880 H 165 VAL165 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2661 2654 HG11 8.8550 36.1440 -5.7550 H 165 VAL165 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2662 2655 HG12 9.3320 34.9260 -6.9610 H 165 VAL165 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2663 2656 HG13 8.6060 34.4140 -5.4190 H 165 VAL165 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2664 2657 HG21 10.0480 36.5930 -3.8860 H 165 VAL165 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2665 2658 HG22 9.8950 34.9340 -3.2610 H 165 VAL165 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2666 2659 HG23 11.5000 35.6940 -3.3840 H 165 VAL165 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2667 2660 N 10.7640 32.4080 -7.4270 N.am 166 LEU166 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2668 2661 CA 10.6970 32.0530 -8.8450 C.3 166 LEU166 0.0997
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2669 2662 C 10.0110 33.1320 -9.6160 C.2 166 LEU166 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2670 2663 O 9.0220 33.7640 -9.2670 O.2 166 LEU166 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2671 2664 CB 9.8840 30.7490 -9.0090 C.3 166 LEU166 -0.0236
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2672 2665 CG 10.3230 29.5060 -8.3030 C.3 166 LEU166 -0.0446
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2673 2666 CD1 9.1550 28.5200 -8.1650 C.3 166 LEU166 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2674 2667 CD2 11.4270 28.8170 -9.0920 C.3 166 LEU166 -0.0626
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2675 2668 H 10.2270 31.8190 -6.8070 H 166 LEU166 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2676 2669 HA 11.7070 31.9420 -9.2400 H 166 LEU166 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2677 2670 HB2 8.8650 30.9090 -8.6560 H 166 LEU166 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2678 2671 HB3 9.8630 30.4630 -10.0610 H 166 LEU166 0.0290
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2679 2672 HG 10.6750 29.7600 -7.3030 H 166 LEU166 0.0296
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2680 2673 HD11 9.4960 27.6220 -7.6490 H 166 LEU166 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2681 2674 HD12 8.3520 28.9850 -7.5930 H 166 LEU166 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2682 2675 HD13 8.7870 28.2510 -9.1550 H 166 LEU166 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2683 2676 HD21 11.7390 27.9130 -8.5680 H 166 LEU166 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2684 2677 HD22 11.0560 28.5530 -10.0820 H 166 LEU166 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2685 2678 HD23 12.2780 29.4910 -9.1910 H 166 LEU166 0.0232
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2686 2679 N 10.5830 33.4380 -10.7560 N.am 167 SER167 -0.3006
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2687 2680 CA 10.2480 34.4390 -11.7440 C.3 167 SER167 0.1226
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2688 2681 C 9.2250 33.9920 -12.7800 C.2 167 SER167 0.2362
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2689 2682 O 8.5210 34.7910 -13.4110 O.2 167 SER167 -0.2737
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2690 2683 CB 11.5820 34.6200 -12.5740 C.3 167 SER167 0.0711
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2691 2684 OG 12.2370 35.8120 -12.1370 O.3 167 SER167 -0.3927
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2692 2685 H 11.4010 32.9320 -11.0620 H 167 SER167 0.1496
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2693 2686 HA 9.7190 35.2620 -11.2630 H 167 SER167 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2694 2687 HB2 12.2320 33.7600 -12.4100 H 167 SER167 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2695 2688 HB3 11.3430 34.6980 -13.6350 H 167 SER167 0.0580
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2696 2689 HG 13.0490 35.9320 -12.6350 H 167 SER167 0.2095
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2697 2690 N 9.2440 32.7240 -13.0470 N.am 168 ASP168 -0.3021
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2698 2691 CA 8.3870 32.1320 -14.0810 C.3 168 ASP168 0.1045
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2699 2692 C 6.9640 31.8100 -13.6060 C.2 168 ASP168 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2700 2693 O 6.6660 31.5980 -12.4290 O.2 168 ASP168 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2701 2694 CB 9.0860 30.9170 -14.6660 C.3 168 ASP168 0.0138
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2702 2695 CG 9.6750 29.9400 -13.6920 C.2 168 ASP168 0.0440
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2703 2696 OD1 9.3260 28.7490 -13.6480 O.co2 168 ASP168 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2704 2697 OD2 10.5600 30.3160 -12.8830 O.co2 168 ASP168 -0.5497
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2705 2698 H 9.8620 32.1100 -12.5370 H 168 ASP168 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2706 2699 HA 8.3860 32.7720 -14.9630 H 168 ASP168 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2707 2700 HB2 8.3790 30.3440 -15.2660 H 168 ASP168 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2708 2701 HB3 9.9150 31.2420 -15.2940 H 168 ASP168 0.0348
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2709 2702 N 6.1270 31.7020 -14.6600 N.am 169 VAL169 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2710 2703 CA 4.7000 31.3410 -14.4250 C.3 169 VAL169 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2711 2704 C 4.6290 29.9060 -14.0220 C.2 169 VAL169 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2712 2705 O 5.2570 29.0430 -14.6970 O.2 169 VAL169 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2713 2706 CB 3.8060 31.6990 -15.6480 C.3 169 VAL169 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2714 2707 CG1 2.3580 31.2770 -15.4000 C.3 169 VAL169 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2715 2708 CG2 3.9460 33.1670 -15.9340 C.3 169 VAL169 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2716 2709 H 6.4700 31.8650 -15.5960 H 169 VAL169 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2717 2710 HA 4.2590 32.0440 -13.7180 H 169 VAL169 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2718 2711 HB 4.2230 31.2470 -16.5480 H 169 VAL169 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2719 2712 HG11 1.7500 31.5360 -16.2670 H 169 VAL169 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2720 2713 HG12 2.3160 30.2000 -15.2360 H 169 VAL169 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2721 2714 HG13 1.9740 31.7930 -14.5200 H 169 VAL169 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2722 2715 HG21 3.3240 33.4320 -16.7890 H 169 VAL169 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2723 2716 HG22 3.6270 33.7390 -15.0630 H 169 VAL169 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2724 2717 HG23 4.9880 33.3960 -16.1580 H 169 VAL169 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2725 2718 N 3.9410 29.5040 -12.9920 N.am 170 GLN170 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2726 2719 CA 3.7880 28.1340 -12.5410 C.3 170 GLN170 0.0999
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2727 2720 C 2.4270 27.6410 -13.0340 C.2 170 GLN170 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2728 2721 O 1.5560 28.4570 -13.3310 O.2 170 GLN170 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2729 2722 CB 3.8600 28.0910 -10.9890 C.3 170 GLN170 -0.0177
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2730 2723 CG 5.0270 28.9530 -10.4950 C.3 170 GLN170 0.0259
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2731 2724 CD 6.3710 28.4820 -11.0060 C.2 170 GLN170 0.2106
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2732 2725 OE1 6.6790 27.3150 -10.9190 O.2 170 GLN170 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2733 2726 NE2 7.1620 29.4190 -11.5280 N.am 170 GLN170 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2734 2727 H 3.4480 30.1750 -12.4210 H 170 GLN170 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2735 2728 HA 4.5910 27.5230 -12.9530 H 170 GLN170 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2736 2729 HB2 2.9290 28.4740 -10.5710 H 170 GLN170 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2737 2730 HB3 4.0090 27.0630 -10.6600 H 170 GLN170 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2738 2731 HG2 4.8880 29.9810 -10.8310 H 170 GLN170 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2739 2732 HG3 5.0610 28.9290 -9.4060 H 170 GLN170 0.0359
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2740 2733 HE22 8.0720 29.1690 -11.8870 H 170 GLN170 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2741 2734 HE21 6.8510 30.3790 -11.5650 H 170 GLN170 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2742 2735 N 2.2290 26.3610 -13.0130 N.am 171 GLU171 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2743 2736 CA 0.9780 25.7430 -13.3900 C.3 171 GLU171 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2744 2737 C 0.7070 24.4840 -12.6170 C.2 171 GLU171 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2745 2738 O 1.6330 23.6330 -12.5840 O.2 171 GLU171 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2746 2739 CB 1.0170 25.2990 -14.8440 C.3 171 GLU171 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2747 2740 CG 0.1720 26.1190 -15.7730 C.3 171 GLU171 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2748 2741 CD -0.5450 25.3930 -16.8880 C.2 171 GLU171 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2749 2742 OE1 -1.3680 24.5190 -16.7350 O.co2 171 GLU171 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2750 2743 OE2 -0.2130 25.9060 -17.9660 O.co2 171 GLU171 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2751 2744 H 2.9710 25.7400 -12.7220 H 171 GLU171 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2752 2745 HA 0.1530 26.4120 -13.1440 H 171 GLU171 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2753 2746 HB2 2.0400 25.3580 -15.2150 H 171 GLU171 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2754 2747 HB3 0.6620 24.2710 -14.9200 H 171 GLU171 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2755 2748 HG2 -0.6120 26.6200 -15.2050 H 171 GLU171 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2756 2749 HG3 0.7940 26.8640 -16.2680 H 171 GLU171 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2757 2750 N -0.4800 24.3280 -12.0780 N.am 172 GLU172 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2758 2751 CA -0.8240 23.0920 -11.3680 C.3 172 GLU172 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2759 2752 C -2.3240 22.9270 -11.5280 C.2 172 GLU172 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2760 2753 O -3.0920 23.8800 -11.2850 O.2 172 GLU172 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2761 2754 CB -0.5720 22.9960 -9.8740 C.3 172 GLU172 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2762 2755 CG 0.8020 23.2270 -9.3110 C.3 172 GLU172 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2763 2756 CD 0.8500 23.2560 -7.7910 C.2 172 GLU172 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2764 2757 OE1 1.0010 24.2950 -7.2000 O.co2 172 GLU172 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2765 2758 OE2 0.7380 22.1050 -7.3500 O.co2 172 GLU172 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2766 2759 H -1.1680 25.0640 -12.1500 H 172 GLU172 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2767 2760 HA -0.3110 22.2500 -11.8330 H 172 GLU172 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2768 2761 HB2 -1.1880 23.7290 -9.3530 H 172 GLU172 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2769 2762 HB3 -0.8260 21.9950 -9.5260 H 172 GLU172 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2770 2763 HG2 1.4680 22.4290 -9.6390 H 172 GLU172 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2771 2764 HG3 1.1830 24.1860 -9.6630 H 172 GLU172 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2772 2765 N -2.6910 21.7080 -11.9080 N.am 173 LYS173 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2773 2766 CA -4.1280 21.3790 -12.0790 C.3 173 LYS173 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2774 2767 C -4.7850 22.2830 -13.1170 C.2 173 LYS173 0.2337
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2775 2768 O -5.9890 22.5840 -13.0200 O.2 173 LYS173 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2776 2769 CB -4.8490 21.4590 -10.7650 C.3 173 LYS173 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2777 2770 CG -4.4880 20.5740 -9.5530 C.3 173 LYS173 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2778 2771 CD -5.8000 20.1820 -8.8640 C.3 173 LYS173 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2779 2772 CE -5.7410 20.0590 -7.3670 C.3 173 LYS173 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2780 2773 NZ -4.5190 19.3340 -6.9350 N.4 173 LYS173 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2781 2774 H -1.9910 21.0010 -12.0820 H 173 LYS173 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2782 2775 HA -4.2310 20.3260 -12.3420 H 173 LYS173 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2783 2776 HB2 -4.7500 22.4650 -10.3560 H 173 LYS173 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2784 2777 HB3 -5.9040 21.2300 -10.9140 H 173 LYS173 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2785 2778 HG2 -3.9570 19.6860 -9.8960 H 173 LYS173 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2786 2779 HG3 -3.8510 21.1350 -8.8690 H 173 LYS173 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2787 2780 HD2 -6.5620 20.9320 -9.0780 H 173 LYS173 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2788 2781 HD3 -6.1310 19.2120 -9.2360 H 173 LYS173 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2789 2782 HE2 -5.7310 21.0530 -6.9200 H 173 LYS173 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2790 2783 HE3 -6.6140 19.5110 -7.0120 H 173 LYS173 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2791 2784 HZ1 -4.5060 19.2660 -5.9270 H 173 LYS173 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2792 2785 HZ2 -4.5190 18.4060 -7.3340 H 173 LYS173 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2793 2786 HZ3 -3.7010 19.8360 -7.2490 H 173 LYS173 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2794 2787 N -4.0000 22.7560 -14.0720 N.am 174 GLY174 -0.3052
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2795 2788 CA -4.4050 23.6470 -15.1250 C.3 174 GLY174 0.0882
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2796 2789 C -4.6550 25.0740 -14.7490 C.2 174 GLY174 0.2308
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2797 2790 O -5.2360 25.8550 -15.5070 O.2 174 GLY174 -0.2741
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2798 2791 H -3.0250 22.4940 -14.1010 H 174 GLY174 0.1492
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2799 2792 HA2 -3.6320 23.6780 -15.8930 H 174 GLY174 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2800 2793 HA3 -5.3380 23.2920 -15.5630 H 174 GLY174 0.0558
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2801 2794 N -4.1910 25.4150 -13.5480 N.am 175 ILE175 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2802 2795 CA -4.3390 26.7970 -13.0210 C.3 175 ILE175 0.1019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2803 2796 C -2.9650 27.3930 -13.0910 C.2 175 ILE175 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2804 2797 O -2.0230 26.7720 -12.5460 O.2 175 ILE175 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2805 2798 CB -4.9360 26.7220 -11.5610 C.3 175 ILE175 -0.0171
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2806 2799 CG1 -6.3590 26.0980 -11.5370 C.3 175 ILE175 -0.0512
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2807 2800 CG2 -4.9980 28.2010 -10.9850 C.3 175 ILE175 -0.0603
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2808 2801 CD1 -6.8780 25.7500 -10.1050 C.3 175 ILE175 -0.0650
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2809 2802 H -3.7260 24.7280 -12.9720 H 175 ILE175 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2810 2803 HA -5.0810 27.3340 -13.6110 H 175 ILE175 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2811 2804 HB -4.2830 26.1180 -10.9310 H 175 ILE175 0.0321
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2812 2805 HG12 -7.0710 26.7980 -11.9750 H 175 ILE175 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2813 2806 HG13 -6.3600 25.1720 -12.1120 H 175 ILE175 0.0266
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2814 2807 HG21 -5.4070 28.1810 -9.9750 H 175 ILE175 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2815 2808 HG22 -3.9940 28.6250 -10.9610 H 175 ILE175 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2816 2809 HG23 -5.6350 28.8130 -11.6230 H 175 ILE175 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2817 2810 HD11 -7.8770 25.3190 -10.1750 H 175 ILE175 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2818 2811 HD12 -6.2050 25.0310 -9.6390 H 175 ILE175 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2819 2812 HD13 -6.9150 26.6570 -9.5010 H 175 ILE175 0.0230
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2820 2813 N -2.8020 28.5390 -13.7300 N.am 176 LYS176 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2821 2814 CA -1.4940 29.2010 -13.7870 C.3 176 LYS176 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2822 2815 C -1.4090 30.2390 -12.6680 C.2 176 LYS176 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2823 2816 O -2.4080 30.8730 -12.3210 O.2 176 LYS176 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2824 2817 CB -1.4050 30.0530 -15.0640 C.3 176 LYS176 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2825 2818 CG -1.1880 29.0900 -16.2870 C.3 176 LYS176 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2826 2819 CD -1.1180 30.0040 -17.5350 C.3 176 LYS176 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2827 2820 CE -0.3240 29.3360 -18.6550 C.3 176 LYS176 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2828 2821 NZ -1.0200 28.0730 -19.0990 N.4 176 LYS176 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2829 2822 H -3.5870 28.9760 -14.1910 H 176 LYS176 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2830 2823 HA -0.7130 28.4870 -13.5240 H 176 LYS176 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2831 2824 HB2 -2.3300 30.6150 -15.1910 H 176 LYS176 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2832 2825 HB3 -0.5680 30.7460 -14.9810 H 176 LYS176 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2833 2826 HG2 -0.2610 28.5330 -16.1520 H 176 LYS176 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2834 2827 HG3 -2.0230 28.3930 -16.3540 H 176 LYS176 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2835 2828 HD2 -2.1270 30.2070 -17.8940 H 176 LYS176 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2836 2829 HD3 -0.6300 30.9430 -17.2720 H 176 LYS176 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2837 2830 HE2 -0.2450 30.0180 -19.5020 H 176 LYS176 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2838 2831 HE3 0.6740 29.0870 -18.2950 H 176 LYS176 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2839 2832 HZ1 -0.4890 27.6380 -19.8390 H 176 LYS176 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2840 2833 HZ2 -1.0930 27.4360 -18.3190 H 176 LYS176 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2841 2834 HZ3 -1.9450 28.2990 -19.4370 H 176 LYS176 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2842 2835 N -0.2010 30.3900 -12.1470 N.am 177 TYR177 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2843 2836 CA -0.0060 31.3970 -11.1040 C.3 177 TYR177 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2844 2837 C 1.4450 31.9070 -11.1140 C.2 177 TYR177 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2845 2838 O 2.2890 31.1830 -11.6460 O.2 177 TYR177 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2846 2839 CB -0.3720 30.7770 -9.7870 C.3 177 TYR177 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2847 2840 CG 0.2890 29.5430 -9.2450 C.ar 177 TYR177 -0.0449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2848 2841 CD1 1.4540 29.6860 -8.4690 C.ar 177 TYR177 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2849 2842 CD2 -0.2050 28.2790 -9.5490 C.ar 177 TYR177 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2850 2843 CE1 2.0600 28.5360 -7.9340 C.ar 177 TYR177 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2851 2844 CE2 0.3860 27.1250 -8.9900 C.ar 177 TYR177 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2852 2845 CZ 1.5280 27.2920 -8.1760 C.ar 177 TYR177 0.1169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2853 2846 OH 2.1050 26.1520 -7.6410 O.3 177 TYR177 -0.5068
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2854 2847 H 0.5640 29.8160 -12.4710 H 177 TYR177 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2855 2848 HA -0.7100 32.2160 -11.2520 H 177 TYR177 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2856 2849 HB2 -0.2050 31.4980 -8.9870 H 177 TYR177 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2857 2850 HB3 -1.4230 30.4880 -9.8010 H 177 TYR177 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2858 2851 HD1 1.8680 30.6680 -8.2930 H 177 TYR177 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2859 2852 HD2 -1.0470 28.1750 -10.2170 H 177 TYR177 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2860 2853 HE1 2.9500 28.6260 -7.3280 H 177 TYR177 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2861 2854 HE2 -0.0360 26.1510 -9.1900 H 177 TYR177 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2862 2855 HH 1.6030 25.3810 -7.9140 H 177 TYR177 0.2921
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2863 2856 N 1.6660 33.0400 -10.5430 N.am 178 LYS178 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2864 2857 CA 3.0330 33.5820 -10.4390 C.3 178 LYS178 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2865 2858 C 3.1830 34.2760 -9.0910 C.2 178 LYS178 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2866 2859 O 2.2320 34.7760 -8.4770 O.2 178 LYS178 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2867 2860 CB 3.4130 34.5170 -11.5580 C.3 178 LYS178 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2868 2861 CG 2.5670 35.7700 -11.7610 C.3 178 LYS178 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2869 2862 CD 3.4720 36.7460 -12.5680 C.3 178 LYS178 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2870 2863 CE 2.9850 38.1650 -12.7190 C.3 178 LYS178 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2871 2864 NZ 1.4720 38.1680 -12.7450 N.4 178 LYS178 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2872 2865 H 0.8970 33.5700 -10.1590 H 178 LYS178 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2873 2866 HA 3.7550 32.7790 -10.5860 H 178 LYS178 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2874 2867 HB2 4.4270 34.8830 -11.3980 H 178 LYS178 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2875 2868 HB3 3.3650 33.9860 -12.5080 H 178 LYS178 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2876 2869 HG2 1.6630 35.5130 -12.3130 H 178 LYS178 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2877 2870 HG3 2.2940 36.1860 -10.7910 H 178 LYS178 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2878 2871 HD2 4.4470 36.8210 -12.0860 H 178 LYS178 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2879 2872 HD3 3.5970 36.3700 -13.5830 H 178 LYS178 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2880 2873 HE2 3.3390 38.7620 -11.8790 H 178 LYS178 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2881 2874 HE3 3.3690 38.5840 -13.6490 H 178 LYS178 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2882 2875 HZ1 1.1380 39.1160 -12.8460 H 178 LYS178 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2883 2876 HZ2 1.1470 37.6130 -13.5230 H 178 LYS178 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2884 2877 HZ3 1.1190 37.7780 -11.8830 H 178 LYS178 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2885 2878 N 4.4320 34.3100 -8.6980 N.am 179 PHE179 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2886 2879 CA 4.8290 34.9350 -7.4000 C.3 179 PHE179 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2887 2880 C 5.3520 36.3220 -7.6140 C.2 179 PHE179 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2888 2881 O 6.1710 36.5510 -8.5340 O.2 179 PHE179 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2889 2882 CB 5.8520 34.0810 -6.6780 C.3 179 PHE179 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2890 2883 CG 5.5640 32.6680 -6.4580 C.ar 179 PHE179 -0.0451
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2891 2884 CD1 6.2810 31.6320 -7.0590 C.ar 179 PHE179 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2892 2885 CD2 4.4780 32.3690 -5.5840 C.ar 179 PHE179 -0.0585
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2893 2886 CE1 5.8830 30.3040 -6.7830 C.ar 179 PHE179 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2894 2887 CE2 4.1270 31.0460 -5.2850 C.ar 179 PHE179 -0.0615
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2895 2888 CZ 4.8540 30.0300 -5.9320 C.ar 179 PHE179 -0.0617
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2896 2889 H 5.1550 33.9070 -9.2770 H 179 PHE179 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2897 2890 HA 3.9790 34.9290 -6.7180 H 179 PHE179 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2898 2891 HB2 6.7880 34.0850 -7.2360 H 179 PHE179 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2899 2892 HB3 6.0230 34.4840 -5.6800 H 179 PHE179 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2900 2893 HD1 7.1110 31.8580 -7.7120 H 179 PHE179 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2901 2894 HD2 3.9080 33.1700 -5.1380 H 179 PHE179 0.0620
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2902 2895 HE1 6.3980 29.4780 -7.2510 H 179 PHE179 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2903 2896 HE2 3.3300 30.8440 -4.5850 H 179 PHE179 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2904 2897 HZ 4.5740 29.0060 -5.7360 H 179 PHE179 0.0618
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2905 2898 N 4.9720 37.2480 -6.7930 N.am 180 GLU180 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2906 2899 CA 5.3650 38.6740 -6.8760 C.3 180 GLU180 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2907 2900 C 5.7330 39.2360 -5.5240 C.2 180 GLU180 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2908 2901 O 5.1570 38.7750 -4.5160 O.2 180 GLU180 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2909 2902 CB 4.1850 39.5190 -7.3520 C.3 180 GLU180 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2910 2903 CG 3.6490 39.2250 -8.7390 C.3 180 GLU180 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2911 2904 CD 2.5850 40.2120 -9.1160 C.2 180 GLU180 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2912 2905 OE1 1.7930 40.8760 -8.4810 O.co2 180 GLU180 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2913 2906 OE2 2.6350 40.3400 -10.3670 O.co2 180 GLU180 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2914 2907 H 4.3600 37.0200 -6.0230 H 180 GLU180 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2915 2908 HA 6.2640 38.7690 -7.4850 H 180 GLU180 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2916 2909 HB2 3.3420 39.3810 -6.6750 H 180 GLU180 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2917 2910 HB3 4.4720 40.5710 -7.3640 H 180 GLU180 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2918 2911 HG2 4.4610 39.2880 -9.4640 H 180 GLU180 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2919 2912 HG3 3.2220 38.2220 -8.7590 H 180 GLU180 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2920 2913 N 6.6500 40.1830 -5.4970 N.am 181 VAL181 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2921 2914 CA 7.0970 40.7860 -4.2430 C.3 181 VAL181 0.1017
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2922 2915 C 6.9290 42.3090 -4.3520 C.2 181 VAL181 0.2342
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2923 2916 O 7.4390 42.8710 -5.3540 O.2 181 VAL181 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2924 2917 CB 8.5280 40.3620 -3.8760 C.3 181 VAL181 -0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2925 2918 CG1 8.8180 40.8880 -2.4570 C.3 181 VAL181 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2926 2919 CG2 8.7310 38.8670 -3.9060 C.3 181 VAL181 -0.0605
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2927 2920 H 7.0630 40.5100 -6.3580 H 181 VAL181 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2928 2921 HA 6.5620 40.3310 -3.4090 H 181 VAL181 0.0597
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2929 2922 HB 9.2280 40.7780 -4.6000 H 181 VAL181 0.0318
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2930 2923 HG11 9.8290 40.6040 -2.1630 H 181 VAL181 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2931 2924 HG12 8.7290 41.9740 -2.4460 H 181 VAL181 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2932 2925 HG13 8.1020 40.4580 -1.7560 H 181 VAL181 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2933 2926 HG21 9.7610 38.6340 -3.6380 H 181 VAL181 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2934 2927 HG22 8.0550 38.3940 -3.1940 H 181 VAL181 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2935 2928 HG23 8.5230 38.4920 -4.9080 H 181 VAL181 0.0233
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2936 2929 N 6.2740 42.9040 -3.3840 N.am 182 TYR182 -0.3022
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2937 2930 CA 6.0660 44.3460 -3.4200 C.3 182 TYR182 0.1034
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2938 2931 C 6.7270 44.8810 -2.1520 C.2 182 TYR182 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2939 2932 O 6.8290 44.1140 -1.1950 O.2 182 TYR182 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2940 2933 CB 4.6250 44.8460 -3.4960 C.3 182 TYR182 -0.0007
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2941 2934 CG 3.8760 44.4630 -4.7470 C.ar 182 TYR182 -0.0449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2942 2935 CD1 3.4360 43.1470 -4.8750 C.ar 182 TYR182 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2943 2936 CD2 3.5930 45.3350 -5.7970 C.ar 182 TYR182 -0.0551
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2944 2937 CE1 2.7180 42.6430 -5.9530 C.ar 182 TYR182 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2945 2938 CE2 2.9090 44.8700 -6.9170 C.ar 182 TYR182 -0.0199
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2946 2939 CZ 2.4400 43.5580 -6.9770 C.ar 182 TYR182 0.1169
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2947 2940 OH 1.7390 43.1640 -8.1060 O.3 182 TYR182 -0.5068
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2948 2941 H 5.9130 42.3630 -2.6120 H 182 TYR182 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2949 2942 HA 6.4950 44.7530 -4.3360 H 182 TYR182 0.0598
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2950 2943 HB2 4.0550 44.4430 -2.6590 H 182 TYR182 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2951 2944 HB3 4.6150 45.9350 -3.4510 H 182 TYR182 0.0336
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2952 2945 HD1 3.6480 42.4290 -4.0970 H 182 TYR182 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2953 2946 HD2 3.9040 46.3680 -5.7400 H 182 TYR182 0.0621
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2954 2947 HE1 2.4130 41.6070 -5.9620 H 182 TYR182 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2955 2948 HE2 2.7350 45.5280 -7.7550 H 182 TYR182 0.0654
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2956 2949 HH 1.6400 43.9120 -8.6990 H 182 TYR182 0.2921
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2957 2950 N 7.0840 46.1620 -2.2110 N.am 183 GLU183 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2958 2951 CA 7.6360 46.7270 -0.9870 C.3 183 GLU183 0.0998
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2959 2952 C 7.2250 48.1780 -0.8050 C.2 183 GLU183 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2960 2953 O 6.8850 48.8550 -1.7810 O.2 183 GLU183 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2961 2954 CB 9.1340 46.6100 -0.9540 C.3 183 GLU183 -0.0201
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2962 2955 CG 9.8330 47.7030 -0.1570 C.3 183 GLU183 -0.0019
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2963 2956 CD 11.3270 47.5890 -0.3300 C.2 183 GLU183 0.0871
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2964 2957 OE1 11.9020 46.5190 -0.3220 O.co2 183 GLU183 -0.3090
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2965 2958 OE2 11.8390 48.7100 -0.4920 O.co2 183 GLU183 -0.8476
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2966 2959 H 6.9650 46.6800 -3.0700 H 183 GLU183 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2967 2960 HA 7.3260 46.1220 -0.1350 H 183 GLU183 0.0595
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2968 2961 HB2 9.4150 45.6590 -0.5020 H 183 GLU183 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2969 2962 HB3 9.5250 46.6590 -1.9700 H 183 GLU183 0.0292
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2970 2963 HG2 9.5040 48.6790 -0.5120 H 183 GLU183 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2971 2964 HG3 9.5850 47.5990 0.8990 H 183 GLU183 0.0333
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2972 2965 N 7.2490 48.5710 0.4420 N.am 184 LYS184 -0.3025
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2973 2966 CA 6.9900 49.9820 0.8340 C.3 184 LYS184 0.0994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2974 2967 C 7.8760 50.2690 2.0450 C.2 184 LYS184 0.2340
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2975 2968 O 8.5510 49.4210 2.6690 O.2 184 LYS184 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2976 2969 CB 5.5230 50.2660 1.0550 C.3 184 LYS184 -0.0258
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2977 2970 CG 5.0190 49.8670 2.4190 C.3 184 LYS184 -0.0461
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2978 2971 CD 4.0290 50.8460 3.0380 C.3 184 LYS184 -0.0126
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2979 2972 CE 3.8080 50.4090 4.4750 C.3 184 LYS184 -0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2980 2973 NZ 3.0780 51.4030 5.2940 N.4 184 LYS184 0.2185
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2981 2974 H 7.4480 47.9070 1.1770 H 184 LYS184 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2982 2975 HA 7.1350 50.6320 -0.0290 H 184 LYS184 0.0594
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2983 2976 HB2 5.3390 51.3350 0.9450 H 184 LYS184 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2984 2977 HB3 4.9320 49.7180 0.3210 H 184 LYS184 0.0288
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2985 2978 HG2 4.5130 48.9040 2.3520 H 184 LYS184 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2986 2979 HG3 5.8590 49.7880 3.1090 H 184 LYS184 0.0268
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2987 2980 HD2 4.4430 51.8540 3.0020 H 184 LYS184 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2988 2981 HD3 3.0930 50.8190 2.4800 H 184 LYS184 0.0317
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2989 2982 HE2 3.2260 49.4870 4.4900 H 184 LYS184 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2990 2983 HE3 4.7710 50.2380 4.9560 H 184 LYS184 0.0813
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2991 2984 HZ1 2.9670 51.0490 6.2330 H 184 LYS184 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2992 2985 HZ2 3.6000 52.2670 5.3200 H 184 LYS184 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2993 2986 HZ3 2.1690 51.5720 4.8880 H 184 LYS184 0.1994
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2994 2987 N 7.9280 51.5270 2.4340 N.am 185 ASN185 -0.3020
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2995 2988 CA 8.7200 52.0180 3.5870 C.3 185 ASN185 0.1076
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2996 2989 C 8.3350 53.4990 3.7360 C.2 185 ASN185 0.2343
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2997 2990 O 8.7320 54.3800 2.9660 O.2 185 ASN185 -0.2738
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2998 2991 CB 10.2110 51.7100 3.5230 C.3 185 ASN185 0.0506
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
2999 2992 CG 10.9300 51.9700 4.8360 C.2 185 ASN185 0.2127
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3000 2993 OD1 10.3360 52.5690 5.7550 O.2 185 ASN185 -0.2760
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3001 2994 ND2 12.1830 51.5620 5.0350 N.am 185 ASN185 -0.3293
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3002 2995 H 7.4040 52.2320 1.9350 H 185 ASN185 0.1495
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3003 2996 HA 8.5860 51.3440 4.4330 H 185 ASN185 0.0599
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3004 2997 HB2 10.3550 50.6600 3.2700 H 185 ASN185 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3005 2998 HB3 10.6790 52.3340 2.7610 H 185 ASN185 0.0381
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3006 2999 HD22 12.6400 51.7470 5.9160 H 185 ASN185 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3007 3000 HD21 12.6750 51.0680 4.3040 H 185 ASN185 0.1449
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3008 3001 N 7.5240 53.6750 4.7590 N.am 186 ASP186 -0.3054
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3009 3002 CA 6.9260 54.9520 5.1820 C.3 186 ASP186 0.0685
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3010 3003 C 7.0870 55.1540 6.6980 C.2 186 ASP186 0.0623
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3011 3004 O 8.0780 54.5190 7.1630 O.co2 186 ASP186 -0.5479
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3012 3005 CB 5.4660 54.9070 4.7080 C.3 186 ASP186 0.0197
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3013 3006 CG 4.6530 53.7910 5.3520 C.2 186 ASP186 0.0892
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3014 3007 OD1 5.1570 53.0030 6.1750 O.co2 186 ASP186 -0.3089
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3015 3008 OD2 3.4390 53.7190 5.0000 O.co2 186 ASP186 -0.8475
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3016 3009 OXT 6.2870 55.8730 7.3340 O.co2 186 ASP186 -0.5479
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3017 3010 H 7.2600 52.8890 5.3350 H 186 ASP186 0.1494
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3018 3011 HA 7.3690 55.7680 4.6110 H 186 ASP186 0.0564
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3019 3012 HB2 4.9760 55.8500 4.9510 H 186 ASP186 0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3020 3013 HB3 5.4380 54.7500 3.6300 H 186 ASP186 0.0354
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3021 @<TRIPOS>BOND
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3022 1 2832 2821 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3023 2 2830 2820 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3024 3 2834 2821 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3025 4 2821 2820 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3026 5 2821 2833 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3027 6 2820 2831 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3028 7 2820 2819 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3029 8 2743 2741 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3030 9 2828 2819 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3031 10 2819 2829 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3032 11 2819 2818 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3033 12 2232 2225 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3034 13 2741 2742 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3035 14 2741 2740 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3036 15 2715 2708 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3037 16 2711 2706 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3038 17 2827 2818 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3039 18 2234 2225 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3040 19 2818 2826 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3041 20 2818 2817 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3042 21 2749 2740 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3043 22 2712 2707 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3044 23 2233 2225 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3045 24 2225 2224 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3046 25 2717 2708 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3047 26 2708 2706 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3048 27 2708 2716 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3049 28 2792 2788 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3050 29 2740 2748 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3051 30 2740 2739 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3052 31 2706 2707 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3053 32 2706 2703 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3054 33 2709 2702 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3055 34 2793 2788 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3056 35 2790 2789 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3057 36 2707 2713 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3058 37 2707 2714 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3059 38 168 161 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3060 39 2701 2694 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3061 40 2700 2694 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3062 41 2746 2739 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3063 42 2824 2817 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3064 43 2788 2789 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3065 44 2788 2787 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3066 45 2817 2825 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3067 46 2817 2814 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3068 47 2699 2691 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3069 48 2229 2222 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3070 49 2747 2739 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3071 50 2739 2736 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3072 51 2789 2794 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3073 52 2248 2240 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3074 53 2705 2704 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3075 54 2251 2243 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3076 55 2694 2691 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3077 56 2694 2695 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3078 57 2702 2703 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3079 58 2702 2692 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3080 59 160 159 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3081 60 2224 2223 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3082 61 2221 2220 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3083 62 2703 2704 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3084 63 2703 2710 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3085 64 161 159 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3086 65 161 169 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3087 66 2822 2813 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3088 67 2243 2250 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3089 68 2243 2241 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3090 69 2791 2787 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3091 70 2691 2692 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3092 71 2691 2690 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3093 72 2787 2767 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3094 73 2228 2222 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3095 74 2704 2718 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3096 75 2222 2223 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3097 76 2222 2219 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3098 77 159 158 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3099 78 2249 2240 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3100 79 2814 2813 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3101 80 2814 2823 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3102 81 2814 2815 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3103 82 2240 2241 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3104 83 2240 2239 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3105 84 2245 2236 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3106 85 2813 2796 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3107 86 2695 2696 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3108 87 2695 2697 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3109 88 2874 2863 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3110 89 2688 2683 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3111 90 2803 2795 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3112 91 2692 2693 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3113 92 2241 2242 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3114 93 2872 2862 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3115 94 2230 2223 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3116 95 2794 2795 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3117 96 2794 2802 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3118 97 2876 2864 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3119 98 2258 2257 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3120 99 2223 2231 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3121 100 2682 2681 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3122 101 2736 2745 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3123 102 2736 2735 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3124 103 2736 2737 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3125 104 2220 2219 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3126 105 2220 2235 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3127 106 2721 2720 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3128 107 2767 2768 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3129 108 2767 2766 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3130 109 2796 2795 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3131 110 2796 2797 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3132 111 2690 2681 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3133 112 2690 2698 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3134 113 2720 2735 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3135 114 2720 2719 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3136 115 2795 2798 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3137 116 2735 2744 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3138 117 2718 2719 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3139 118 2718 2727 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3140 119 2260 2252 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3141 120 2728 2719 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3142 121 2219 2227 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3143 122 2219 2218 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3144 123 2875 2864 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3145 124 2236 2239 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3146 125 2236 2235 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3147 126 2236 2237 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3148 127 2681 2680 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3149 128 2864 2863 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3150 129 2864 2877 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3151 130 2863 2862 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3152 131 2863 2873 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3153 132 2262 2256 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3154 133 2815 2816 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3155 134 2815 2835 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3156 135 2239 2247 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3157 136 2239 2246 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3158 137 2689 2684 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3159 138 2737 2738 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3160 139 2737 2750 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3161 140 2683 2687 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3162 141 2683 2684 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3163 142 2683 2680 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3164 143 2862 2871 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3165 144 2862 2861 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3166 145 2235 2244 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3167 146 2719 2722 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3168 147 2257 2259 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3169 148 2257 2256 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3170 149 2868 2860 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3171 150 2847 2835 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3172 151 158 166 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3173 152 158 167 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3174 153 158 157 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3175 154 2775 2766 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3176 155 2869 2861 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3177 156 2582 2577 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3178 157 2759 2750 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3179 158 2835 2836 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3180 159 165 157 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3181 160 2806 2799 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3182 161 2774 2765 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3183 162 2766 2765 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3184 163 2766 2769 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3185 164 2750 2751 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3186 165 2252 2237 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3187 166 2252 2253 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3188 167 2805 2799 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3189 168 2256 2263 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3190 169 2256 2253 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3191 170 2765 2752 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3192 171 2733 2726 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3193 172 2760 2751 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3194 173 2226 2218 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3195 174 2861 2860 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3196 175 2861 2870 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3197 176 2680 2686 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3198 177 2680 2679 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3199 178 2218 2201 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3200 179 2237 2238 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3201 180 2838 2837 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3202 181 157 164 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3203 182 157 154 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3204 183 2809 2800 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3205 184 2734 2726 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3206 185 2798 2799 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3207 186 2798 2800 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3208 187 2798 2804 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3209 188 2860 2867 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3210 189 2860 2857 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3211 190 2799 2801 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3212 191 2752 2751 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3213 192 2752 2753 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3214 193 2726 2724 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3215 194 2751 2754 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3216 195 2595 2593 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3217 196 2553 2542 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3218 197 2848 2836 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3219 198 2584 2578 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3220 199 2253 2261 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3221 200 2253 2254 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3222 201 2577 2581 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3223 202 2577 2578 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3224 203 2577 2574 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3225 204 2837 2836 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3226 205 2837 2856 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3227 206 2836 2839 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3228 207 2551 2542 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3229 208 2685 2679 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3230 209 2724 2725 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3231 210 2724 2723 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3232 211 2722 2730 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3233 212 2722 2729 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3234 213 2722 2723 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3235 214 2800 2808 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3236 215 2800 2807 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3237 216 2583 2578 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3238 217 2777 2769 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3239 218 2255 2254 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3240 219 2580 2574 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3241 220 2731 2723 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3242 221 2769 2776 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3243 222 2769 2770 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3244 223 2679 2662 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3245 224 2578 2579 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3246 225 2451 2442 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3247 226 2542 2552 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3248 227 2542 2540 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3249 228 2450 2442 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3250 229 2866 2857 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3251 230 2856 2857 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3252 231 2856 2865 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3253 232 2576 2575 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3254 233 2201 2202 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3255 234 2201 2200 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3256 235 2723 2732 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3257 236 2857 2858 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3258 237 2906 2904 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3259 238 2254 2264 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3260 239 2574 2575 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3261 240 2574 2573 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3262 241 2593 2594 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3263 242 2593 2592 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3264 243 2449 2442 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3265 244 2852 2842 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3266 245 154 163 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3267 246 154 155 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3268 247 154 153 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3269 248 2810 2801 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3270 249 2442 2441 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3271 250 2189 2179 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3272 251 2801 2811 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3273 252 2801 2812 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3274 253 2599 2591 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3275 254 2677 2667 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3276 255 2671 2664 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3277 256 2283 2274 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3278 257 2188 2179 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3279 258 2778 2770 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3280 259 2178 2177 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3281 260 2754 2762 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3282 261 2754 2761 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3283 262 2754 2755 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3284 263 2575 2587 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3285 264 156 155 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3286 265 2850 2839 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3287 266 2839 2840 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3288 267 2839 2849 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3289 268 162 153 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3290 269 181 174 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3291 270 2601 2592 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3292 271 155 170 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3293 272 2764 2755 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3294 273 2763 2755 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3295 274 2191 2180 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3296 275 2282 2273 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3297 276 2662 2663 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3298 277 2662 2661 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3299 278 2213 2205 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3300 279 2208 2200 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3301 280 2546 2539 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3302 281 2770 2779 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3303 282 2770 2771 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3304 283 2842 2840 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3305 284 2842 2844 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3306 285 2274 2273 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3307 286 2274 2272 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3308 287 2547 2540 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3309 288 2911 2903 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3310 289 2179 2180 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3311 290 2179 2176 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3312 291 2463 2461 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3313 292 2447 2440 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3314 293 2214 2205 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3315 294 2281 2272 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3316 295 153 144 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3317 296 2755 2756 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3318 297 2200 2199 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3319 298 2200 2203 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3320 299 2592 2591 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3321 300 2592 2600 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3322 301 2540 2539 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3323 302 2540 2541 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3324 303 2889 2878 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3325 304 2273 2271 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3326 305 2840 2841 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3327 306 2669 2661 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3328 307 2781 2771 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3329 308 2192 2181 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3330 309 2678 2667 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3331 310 2854 2844 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3332 311 2579 2573 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3333 312 2579 2585 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3334 313 2579 2586 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3335 314 2468 2460 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3336 315 2675 2666 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3337 316 179 171 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3338 317 2272 2270 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3339 318 2904 2903 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3340 319 2904 2905 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3341 320 170 178 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3342 321 170 171 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3343 322 2573 2556 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3344 323 2667 2676 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3345 324 2667 2665 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3346 325 2858 2878 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3347 326 2858 2859 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3348 327 2264 2275 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3349 328 2264 2265 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3350 329 2591 2598 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3351 330 2591 2588 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3352 331 2780 2771 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3353 332 2664 2661 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3354 333 2664 2670 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3355 334 2664 2665 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3356 335 2177 2199 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3357 336 2177 2176 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3358 337 2844 2845 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3359 338 2276 2265 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3360 339 2205 2203 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3361 340 2205 2212 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3362 341 2180 2181 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3363 342 2180 2190 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3364 343 2771 2772 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3365 344 2661 2660 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3366 345 2587 2588 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3367 346 2587 2596 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3368 347 2912 2903 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3369 348 2539 2545 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3370 349 2539 2536 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3371 350 2548 2541 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3372 351 2903 2902 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3373 352 2446 2440 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3374 353 2949 2940 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3375 354 2878 2879 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3376 355 2194 2182 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3377 356 2441 2440 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3378 357 2441 2448 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3379 358 2441 2443 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3380 359 174 171 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3381 360 174 180 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3382 361 174 175 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3383 362 2597 2588 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3384 363 2199 2207 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3385 364 356 351 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3386 365 2271 2280 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3387 366 2271 2269 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3388 367 2440 2437 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3389 368 2881 2880 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3390 369 2538 2537 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3391 370 390 381 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3392 371 2453 2443 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3393 372 171 172 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3394 373 2181 2182 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3395 374 2181 2193 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3396 375 2841 2851 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3397 376 2841 2843 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3398 377 2469 2460 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3399 378 2270 2269 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3400 379 2270 2279 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3401 380 391 381 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3402 381 2182 2183 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3403 382 430 424 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3404 383 2588 2589 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3405 384 2541 2550 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3406 385 2541 2549 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3407 386 2176 2187 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3408 387 2176 2175 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3409 388 2460 2461 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3410 389 2460 2459 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3411 390 2665 2666 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3412 391 2665 2672 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3413 392 2461 2462 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3414 393 2265 2268 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3415 394 2265 2266 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3416 395 176 175 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3417 396 357 351 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3418 397 2203 2209 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3419 398 2203 2204 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3420 399 2845 2843 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3421 400 2845 2846 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3422 401 2666 2673 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3423 402 2666 2674 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3424 403 150 146 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3425 404 2269 2268 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3426 405 2557 2556 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3427 406 175 177 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3428 407 2940 2939 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3429 408 2531 2520 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3430 409 2556 2555 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3431 410 2452 2443 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3432 411 144 145 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3433 412 144 143 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3434 413 429 424 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3435 414 2443 2454 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3436 415 2465 2456 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3437 416 2843 2853 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3438 417 2530 2520 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3439 418 2855 2846 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3440 419 2543 2535 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3441 420 2183 2185 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3442 421 2183 2184 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3443 422 381 392 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3444 423 381 379 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3445 424 351 352 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3446 425 351 350 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3447 426 149 143 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3448 427 2186 2175 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3449 428 2756 2758 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3450 429 2756 2757 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3451 430 2198 2185 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3452 431 2948 2938 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3453 432 359 352 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3454 433 424 422 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3455 434 2196 2184 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3456 435 2893 2884 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3457 436 2291 2290 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3458 437 2293 2284 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3459 438 2537 2536 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3460 439 2537 2554 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3461 440 2210 2204 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3462 441 358 352 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3463 442 2880 2879 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3464 443 2880 2898 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3465 444 2185 2197 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3466 445 2439 2438 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3467 446 387 380 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3468 447 2647 2646 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3469 448 2184 2195 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3470 449 389 380 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3471 450 2536 2535 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3472 451 2536 2544 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3473 452 2908 2899 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3474 453 2268 2278 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3475 454 2268 2277 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3476 455 2175 2163 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3477 456 2660 2646 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3478 457 2660 2668 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3479 458 2879 2890 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3480 459 2879 2882 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3481 460 2520 2519 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3482 461 2520 2521 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3483 462 352 346 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3484 463 177 183 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3485 464 177 182 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3486 465 2772 2783 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3487 466 2772 2773 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3488 467 2772 2782 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3489 468 2910 2902 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3490 469 2902 2899 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3491 470 2902 2909 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3492 471 2785 2773 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3493 472 2528 2519 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3494 473 2438 2437 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3495 474 2438 2455 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3496 475 2266 2284 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3497 476 2266 2267 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3498 477 143 146 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3499 478 143 142 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3500 479 2398 2396 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3501 480 2437 2445 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3502 481 2437 2436 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3503 482 2895 2886 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3504 483 2786 2773 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3505 484 2891 2882 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3506 485 192 184 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3507 486 2204 2211 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3508 487 2204 2206 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3509 488 146 147 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3510 489 146 151 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3511 490 2284 2285 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3512 491 2535 2515 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3513 492 2295 2288 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3514 493 2884 2886 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3515 494 2884 2883 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3516 495 172 184 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3517 496 172 173 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3518 497 2527 2518 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3519 498 2456 2455 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3520 499 2456 2459 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3521 500 2456 2457 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3522 501 2455 2464 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3523 502 2459 2467 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3524 503 2459 2466 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3525 504 2563 2555 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3526 505 380 379 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3527 506 380 388 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3528 507 2939 2938 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3529 508 2939 2937 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3530 509 2655 2649 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3531 510 2555 2554 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3532 511 2555 2558 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3533 512 2554 2562 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3534 513 2646 2645 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3535 514 2773 2784 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3536 515 2938 2936 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3537 516 354 350 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3538 517 339 326 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3539 518 2532 2521 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3540 519 196 189 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3541 520 2444 2436 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3542 521 2899 2898 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3543 522 2899 2900 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3544 523 2298 2289 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3545 524 427 421 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3546 525 2589 2590 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3547 526 2589 2602 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3548 527 2898 2907 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3549 528 2886 2888 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3550 529 350 355 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3551 530 350 347 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3552 531 338 326 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3553 532 2614 2602 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3554 533 2290 2289 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3555 534 2290 2292 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3556 535 129 128 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3557 536 2882 2883 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3558 537 2882 2892 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3559 538 2519 2518 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3560 539 2519 2529 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3561 540 379 386 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3562 541 379 378 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3563 542 147 152 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3564 543 2523 2514 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3565 544 184 185 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3566 545 422 421 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3567 546 422 423 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3568 547 2173 2167 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3569 548 2294 2285 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3570 549 2174 2167 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3571 550 2883 2885 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3572 551 2524 2517 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3573 552 2436 2426 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3574 553 385 378 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3575 554 2521 2533 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3576 555 2521 2534 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3577 556 337 323 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3578 557 2920 2913 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3579 558 141 132 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3580 559 2518 2517 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3581 560 2518 2526 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3582 561 2602 2603 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3583 562 2285 2288 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3584 563 2285 2286 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3585 564 2289 2288 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3586 565 2289 2297 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3587 566 326 323 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3588 567 326 327 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3589 568 2163 2164 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3590 569 2163 2162 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3591 570 2288 2296 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3592 571 2403 2395 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3593 572 2217 2206 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3594 573 421 428 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3595 574 421 418 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3596 575 383 375 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3597 576 415 403 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3598 577 190 189 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3599 578 190 191 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3600 579 2396 2397 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3601 580 2396 2395 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3602 581 142 128 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3603 582 142 148 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3604 583 2947 2937 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3605 584 2937 2935 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3606 585 2888 2897 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3607 586 2888 2887 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3608 587 189 197 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3609 588 189 188 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3610 589 346 347 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3611 590 346 324 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3612 591 2169 2162 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3613 592 2206 2216 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3614 593 2206 2215 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3615 594 2515 2514 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3616 595 2515 2516 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3617 596 2649 2654 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3618 597 2649 2656 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3619 598 2649 2648 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3620 599 2167 2172 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3621 600 2167 2165 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3622 601 2458 2457 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3623 602 128 127 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3624 603 342 332 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3625 604 2936 2946 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3626 605 2936 2934 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3627 606 2457 2470 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3628 607 2514 2517 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3629 608 2514 2513 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3630 609 378 375 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3631 610 378 384 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3632 611 2517 2525 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3633 612 2653 2648 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3634 613 2408 2407 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3635 614 2565 2558 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3636 615 2495 2494 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3637 616 323 324 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3638 617 323 322 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3639 618 425 417 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3640 619 2885 2887 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3641 620 2885 2894 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3642 621 2558 2564 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3643 622 2558 2559 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3644 623 363 362 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3645 624 2900 2913 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3646 625 2900 2901 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3647 626 416 403 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3648 627 2913 2914 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3649 628 2148 2147 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3650 629 347 348 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3651 630 347 353 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3652 631 193 185 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3653 632 2645 2648 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3654 633 2645 2652 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3655 634 2645 2644 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3656 635 2395 2404 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3657 636 2395 2394 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3658 637 403 401 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3659 638 2156 2150 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3660 639 2916 2915 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3661 640 185 188 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3662 641 185 186 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3663 642 205 201 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3664 643 2568 2560 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3665 644 2162 2165 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3666 645 2162 2161 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3667 646 2887 2896 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3668 647 2648 2650 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3669 648 349 348 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3670 649 2605 2604 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3671 650 404 393 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3672 651 132 139 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3673 652 132 140 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3674 653 132 130 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3675 654 375 374 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3676 655 375 376 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3677 656 2415 2409 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3678 657 327 329 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3679 658 327 328 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3680 659 135 130 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3681 660 2426 2425 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3682 661 2426 2427 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3683 662 311 310 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3684 663 2433 2425 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3685 664 332 329 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3686 665 332 334 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3687 666 2430 2429 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3688 667 2402 2394 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3689 668 324 325 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3690 669 2651 2644 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3691 670 2155 2150 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3692 671 2413 2405 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3693 672 406 397 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3694 673 348 360 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3695 674 188 194 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3696 675 188 195 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3697 676 2928 2919 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3698 677 2422 2412 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3699 678 2935 2934 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3700 679 2935 2945 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3701 680 442 435 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3702 681 409 398 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3703 682 2154 2149 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3704 683 2286 2287 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3705 684 2286 2299 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3706 685 2354 2345 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3707 686 2419 2411 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3708 687 329 331 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3709 688 413 402 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3710 689 418 417 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3711 690 418 426 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3712 691 418 419 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3713 692 2934 2933 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3714 693 2644 2639 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3715 694 2165 2170 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3716 695 2165 2166 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3717 696 2603 2604 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3718 697 2603 2615 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3719 698 2603 2606 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3720 699 444 436 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3721 700 417 395 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3722 701 199 191 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3723 702 133 126 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3724 703 373 366 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3725 704 2479 2470 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3726 705 340 328 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3727 706 2470 2471 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3728 707 316 312 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3729 708 191 198 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3730 709 191 200 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3731 710 2922 2917 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3732 711 2494 2513 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3733 712 2494 2493 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3734 713 2604 2623 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3735 714 2305 2299 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3736 715 362 374 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3737 716 362 361 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3738 717 2150 2149 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3739 718 2150 2157 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3740 719 322 310 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3741 720 322 336 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3742 721 344 334 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3743 722 2566 2559 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3744 723 445 436 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3745 724 2513 2522 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3746 725 2147 2161 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3747 726 2147 2146 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3748 727 393 376 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3749 728 393 394 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3750 729 440 431 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3751 730 328 330 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3752 731 2616 2606 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3753 732 2559 2560 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3754 733 2559 2561 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3755 734 130 127 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3756 735 130 131 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3757 736 2394 2391 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3758 737 2394 2401 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3759 738 2418 2411 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3760 739 2423 2412 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3761 740 127 126 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3762 741 127 134 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3763 742 2407 2424 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3764 743 2407 2406 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3765 744 310 309 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3766 745 2560 2569 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3767 746 2560 2567 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3768 747 201 186 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3769 748 201 202 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3770 749 2161 2168 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3771 750 2630 2624 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3772 751 2425 2424 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3773 752 2425 2428 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3774 753 334 335 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3775 754 2915 2914 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3776 755 2915 2929 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3777 756 374 382 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3778 757 2942 2930 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3779 758 376 377 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3780 759 2400 2391 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3781 760 2914 2917 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3782 761 2914 2921 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3783 762 2617 2606 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3784 763 401 402 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3785 764 401 400 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3786 765 2641 2637 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3787 766 186 187 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3788 767 2299 2300 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3789 768 419 431 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3790 769 419 420 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3791 770 431 432 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3792 771 2409 2411 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3793 772 2409 2406 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3794 773 2409 2410 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3795 774 360 366 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3796 775 360 361 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3797 776 317 312 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3798 777 2411 2420 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3799 778 436 435 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3800 779 436 437 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3801 780 2412 2421 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3802 781 2412 2410 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3803 782 2405 2406 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3804 783 2405 2392 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3805 784 2606 2607 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3806 785 2149 2146 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3807 786 2149 2151 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3808 787 126 118 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3809 788 2309 2304 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3810 789 402 414 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3811 790 410 399 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3812 791 397 398 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3813 792 397 394 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3814 793 397 407 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3815 794 2429 2428 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3816 795 2429 2431 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3817 796 441 432 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3818 797 435 432 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3819 798 435 443 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3820 799 2919 2917 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3821 800 2919 2926 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3822 801 2919 2927 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3823 802 2166 2171 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3824 803 207 202 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3825 804 2657 2650 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3826 805 2917 2918 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3827 806 2639 2640 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3828 807 2639 2638 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3829 808 398 399 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3830 809 398 408 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3831 810 2650 2659 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3832 811 2650 2658 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3833 812 2304 2303 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3834 813 312 309 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3835 814 312 313 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3836 815 2506 2496 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3837 816 366 372 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3838 817 366 365 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3839 818 331 330 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3840 819 331 333 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3841 820 2345 2343 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3842 821 2345 2346 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3843 822 2391 2392 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3844 823 2391 2390 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3845 824 2424 2432 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3846 825 2642 2638 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3847 826 394 395 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3848 827 394 405 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3849 828 2406 2414 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3850 829 2623 2624 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3851 830 2623 2629 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3852 831 330 341 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3853 832 395 396 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3854 833 568 557 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3855 834 2307 2303 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3856 835 2158 2151 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3857 836 2352 2343 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3858 837 432 433 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3859 838 361 367 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3860 839 361 364 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3861 840 123 120 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3862 841 2637 2638 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3863 842 2637 2625 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3864 843 2933 2944 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3865 844 2933 2930 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3866 845 2933 2943 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3867 846 2355 2346 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3868 847 2146 2145 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3869 848 2146 2153 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3870 849 2152 2145 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3871 850 2624 2625 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3872 851 2624 2627 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3873 852 335 333 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3874 853 335 345 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3875 854 2635 2629 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3876 855 2930 2929 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3877 856 2930 2931 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3878 857 370 365 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3879 858 202 203 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3880 859 202 206 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3881 860 2471 2472 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3882 861 2471 2480 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3883 862 2471 2474 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3884 863 2428 2435 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3885 864 2428 2434 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3886 865 2929 2941 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3887 866 2504 2492 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3888 867 204 203 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3889 868 399 400 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3890 869 399 411 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3891 870 309 315 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3892 871 309 308 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3893 872 2492 2472 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3894 873 2492 2493 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3895 874 136 131 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3896 875 2472 2473 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3897 876 2638 2643 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3898 877 504 494 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3899 878 2410 2417 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3900 879 2410 2416 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3901 880 400 412 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3902 881 2507 2496 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3903 882 2493 2496 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3904 883 2493 2505 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3905 884 509 499 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3906 885 2392 2393 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3907 886 570 558 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3908 887 122 117 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3909 888 333 343 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3910 889 131 137 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3911 890 131 138 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3912 891 2572 2561 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3913 892 368 364 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3914 893 2561 2571 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3915 894 2561 2570 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3916 895 2303 2300 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3917 896 2303 2308 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3918 897 2151 2160 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3919 898 2151 2159 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3920 899 2959 2950 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3921 900 2496 2497 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3922 901 510 501 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3923 902 2343 2341 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3924 903 507 497 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3925 904 2346 2344 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3926 905 2625 2626 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3927 906 365 364 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3928 907 365 371 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3929 908 499 497 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3930 909 499 500 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3931 910 318 313 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3932 911 2145 2127 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3933 912 2632 2627 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3934 913 2618 2608 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3935 914 118 117 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3936 915 118 119 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3937 916 2300 2306 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3938 917 2300 2301 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3939 918 2629 2636 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3940 919 2629 2628 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3941 920 557 569 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3942 921 557 556 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3943 922 251 241 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3944 923 497 495 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3945 924 437 438 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3946 925 437 439 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3947 926 364 369 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3948 927 501 500 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3949 928 321 314 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3950 929 203 208 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3951 930 313 314 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3952 931 313 319 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3953 932 2607 2608 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3954 933 2607 2609 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3955 934 500 498 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3956 935 2372 2363 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3957 936 2390 2399 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3958 937 2390 2378 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3959 938 120 117 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3960 939 120 124 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3961 940 120 125 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3962 941 255 242 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3963 942 117 116 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3964 943 2918 2924 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3965 944 2918 2923 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3966 945 2918 2925 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3967 946 505 494 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3968 947 2627 2628 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3969 948 2627 2631 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3970 949 495 494 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3971 950 495 496 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3972 951 247 239 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3973 952 494 491 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3974 953 558 556 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3975 954 558 571 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3976 955 479 470 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3977 956 2482 2474 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3978 957 2302 2301 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3979 958 2950 2931 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3980 959 2950 2951 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3981 960 253 242 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3982 961 2474 2481 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3983 962 2474 2475 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3984 963 308 314 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3985 964 308 291 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3986 965 457 446 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3987 966 2931 2932 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3988 967 2608 2610 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3989 968 2508 2498 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3990 969 2379 2378 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3991 970 2374 2365 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3992 971 498 496 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3993 972 498 508 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3994 973 314 320 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3995 974 2370 2360 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3996 975 556 555 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3997 976 482 471 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3998 977 433 446 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
3999 978 433 434 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4000 979 496 506 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4001 980 2962 2954 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4002 981 588 579 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4003 982 2619 2609 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4004 983 250 240 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4005 984 2359 2358 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4006 985 2301 2310 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4007 986 242 241 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4008 987 242 254 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4009 988 300 293 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4010 989 241 240 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4011 990 241 252 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4012 991 2137 2126 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4013 992 2953 2952 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4014 993 2628 2634 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4015 994 2628 2633 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4016 995 587 579 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4017 996 2350 2340 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4018 997 2378 2377 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4019 998 2109 2108 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4020 999 502 490 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4021 1000 103 102 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4022 1001 2341 2342 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4023 1002 2341 2340 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4024 1003 2344 2353 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4025 1004 2344 2342 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4026 1005 2497 2498 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4027 1006 2497 2499 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4028 1007 2609 2611 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4029 1008 2127 2126 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4030 1009 2127 2128 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4031 1010 2363 2365 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4032 1011 2363 2361 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4033 1012 112 105 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4034 1013 586 579 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4035 1014 292 291 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4036 1015 446 447 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4037 1016 245 238 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4038 1017 2141 2132 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4039 1018 477 466 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4040 1019 2124 2113 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4041 1020 2367 2356 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4042 1021 579 578 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4043 1022 208 216 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4044 1023 208 209 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4045 1024 291 290 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4046 1025 2498 2500 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4047 1026 217 209 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4048 1027 2365 2366 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4049 1028 239 240 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4050 1029 239 238 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4051 1030 239 248 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4052 1031 470 471 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4053 1032 470 480 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4054 1033 470 467 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4055 1034 240 249 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4056 1035 503 491 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4057 1036 491 490 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4058 1037 491 492 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4059 1038 471 481 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4060 1039 471 472 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4061 1040 222 214 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4062 1041 116 102 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4063 1042 116 121 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4064 1043 307 296 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4065 1044 490 468 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4066 1045 2117 2110 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4067 1046 2126 2125 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4068 1047 2126 2129 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4069 1048 223 214 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4070 1049 2342 2351 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4071 1050 2143 2134 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4072 1051 2483 2475 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4073 1052 461 452 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4074 1053 2340 2349 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4075 1054 2340 2337 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4076 1055 2951 2954 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4077 1056 2951 2952 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4078 1057 2951 2960 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4079 1058 2360 2369 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4080 1059 2360 2361 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4081 1060 2360 2357 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4082 1061 246 238 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4083 1062 2475 2484 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4084 1063 2475 2476 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4085 1064 2954 2961 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4086 1065 2954 2955 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4087 1066 463 454 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4088 1067 2509 2499 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4089 1068 301 294 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4090 1069 102 101 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4091 1070 555 567 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4092 1071 555 554 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4093 1072 238 235 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4094 1073 2610 2620 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4095 1074 2610 2612 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4096 1075 2348 2337 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4097 1076 2952 2965 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4098 1077 2139 2129 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4099 1078 293 299 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4100 1079 293 290 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4101 1080 293 294 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4102 1081 2358 2357 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4103 1082 2358 2376 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4104 1083 2123 2113 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4105 1084 2116 2110 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4106 1085 2499 2501 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4107 1086 2132 2134 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4108 1087 2132 2130 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4109 1088 2383 2377 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4110 1089 209 210 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4111 1090 209 212 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4112 1091 2361 2362 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4113 1092 2108 2125 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4114 1093 2108 2107 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4115 1094 466 467 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4116 1095 466 448 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4117 1096 114 106 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4118 1097 105 110 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4119 1098 105 111 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4120 1099 105 104 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4121 1100 2310 2318 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4122 1101 2310 2311 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4123 1102 2113 2122 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4124 1103 2113 2111 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4125 1104 2963 2955 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4126 1105 2377 2376 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4127 1106 2377 2380 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4128 1107 2356 2357 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4129 1108 2356 2338 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4130 1109 2958 2956 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4131 1110 566 554 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4132 1111 2488 2477 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4133 1112 214 221 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4134 1113 214 212 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4135 1114 485 473 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4136 1115 2134 2135 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4137 1116 452 454 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4138 1117 452 451 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4139 1118 454 456 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4140 1119 459 450 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4141 1120 2956 2957 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4142 1121 2956 2955 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4143 1122 467 468 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4144 1123 467 478 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4145 1124 2611 2612 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4146 1125 2611 2621 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4147 1126 2110 2107 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4148 1127 2110 2111 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4149 1128 231 227 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4150 1129 290 298 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4151 1130 290 289 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4152 1131 468 469 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4153 1132 2357 2368 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4154 1133 2125 2136 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4155 1134 2129 2130 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4156 1135 2129 2138 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4157 1136 2337 2338 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4158 1137 2337 2336 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4159 1138 2955 2964 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4160 1139 294 296 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4161 1140 294 295 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4162 1141 565 554 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4163 1142 2114 2106 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4164 1143 2319 2311 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4165 1144 585 577 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4166 1145 230 229 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4167 1146 447 448 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4168 1147 447 450 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4169 1148 447 458 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4170 1149 484 472 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4171 1150 296 305 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4172 1151 296 306 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4173 1152 2500 2510 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4174 1153 2500 2502 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4175 1154 2325 2324 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4176 1155 2366 2375 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4177 1156 2366 2364 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4178 1157 554 553 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4179 1158 522 511 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4180 1159 2376 2382 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4181 1160 2975 2966 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4182 1161 472 473 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4183 1162 472 483 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4184 1163 2612 2613 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4185 1164 2130 2131 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4186 1165 210 227 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4187 1166 210 211 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4188 1167 107 100 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4189 1168 492 511 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4190 1169 492 493 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4191 1170 227 228 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4192 1171 448 449 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4193 1172 212 218 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4194 1173 212 213 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4195 1174 2329 2322 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4196 1175 450 451 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4197 1176 450 460 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4198 1177 113 106 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4199 1178 473 474 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4200 1179 2977 2969 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4201 1180 2476 2485 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4202 1181 2476 2477 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4203 1182 2476 2486 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4204 1183 578 577 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4205 1184 106 104 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4206 1185 106 115 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4207 1186 451 453 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4208 1187 2338 2339 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4209 1188 2118 2111 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4210 1189 2107 2106 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4211 1190 2107 2115 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4212 1191 2111 2112 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4213 1192 2311 2314 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4214 1193 2311 2312 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4215 1194 456 465 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4216 1195 456 455 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4217 1196 104 101 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4218 1197 104 109 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4219 1198 2321 2314 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4220 1199 2965 2966 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4221 1200 2965 2974 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4222 1201 101 100 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4223 1202 101 108 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4224 1203 2384 2380 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4225 1204 584 577 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4226 1205 487 475 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4227 1206 269 263 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4228 1207 2477 2487 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4229 1208 2477 2478 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4230 1209 2100 2090 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4231 1210 511 512 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4232 1211 229 234 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4233 1212 229 228 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4234 1213 577 576 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4235 1214 235 244 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4236 1215 235 234 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4237 1216 235 236 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4238 1217 2501 2502 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4239 1218 2501 2511 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4240 1219 2362 2364 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4241 1220 2362 2371 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4242 1221 2106 2086 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4243 1222 93 86 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4244 1223 2135 2144 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4245 1224 2135 2133 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4246 1225 2324 2336 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4247 1226 2324 2323 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4248 1227 1994 1986 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4249 1228 268 263 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4250 1229 2097 2089 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4251 1230 2380 2385 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4252 1231 2380 2381 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4253 1232 1993 1986 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4254 1233 2966 2969 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4255 1234 2966 2967 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4256 1235 232 228 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4257 1236 289 297 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4258 1237 289 279 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4259 1238 100 83 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4260 1239 234 243 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4261 1240 97 88 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4262 1241 562 552 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4263 1242 2336 2347 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4264 1243 2502 2503 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4265 1244 303 295 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4266 1245 2364 2373 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4267 1246 2976 2969 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4268 1247 219 213 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4269 1248 228 233 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4270 1249 2096 2088 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4271 1250 2322 2312 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4272 1251 2322 2323 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4273 1252 2969 2970 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4274 1253 263 261 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4275 1254 295 302 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4276 1255 295 304 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4277 1256 2314 2320 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4278 1257 2314 2315 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4279 1258 453 455 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4280 1259 453 462 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4281 1260 2490 2478 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4282 1261 455 464 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4283 1262 2094 2085 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4284 1263 2386 2381 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4285 1264 2131 2133 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4286 1265 2131 2140 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4287 1266 2389 2382 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4288 1267 288 281 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4289 1268 524 515 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4290 1269 2382 2381 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4291 1270 2382 2388 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4292 1271 2312 2313 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4293 1272 475 474 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4294 1273 475 486 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4295 1274 2064 2056 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4296 1275 1986 1985 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4297 1276 1986 1995 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4298 1277 2613 2622 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4299 1278 474 476 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4300 1279 553 552 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4301 1280 553 563 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4302 1281 553 564 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4303 1282 561 552 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4304 1283 213 220 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4305 1284 213 215 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4306 1285 2133 2142 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4307 1286 92 86 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4308 1287 2478 2489 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4309 1288 2478 2491 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4310 1289 284 282 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4311 1290 2381 2387 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4312 1291 237 236 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4313 1292 2090 2089 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4314 1293 2090 2099 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4315 1294 2090 2091 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4316 1295 86 88 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4317 1296 86 85 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4318 1297 236 256 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4319 1298 552 549 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4320 1299 90 82 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4321 1300 523 512 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4322 1301 2089 2088 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4323 1302 2089 2098 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4324 1303 279 280 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4325 1304 279 278 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4326 1305 283 282 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4327 1306 2121 2112 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4328 1307 2323 2330 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4329 1308 2323 2326 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4330 1309 2101 2091 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4331 1310 512 515 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4332 1311 512 513 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4333 1312 88 98 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4334 1313 88 99 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4335 1314 282 281 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4336 1315 2112 2119 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4337 1316 2112 2120 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4338 1317 525 515 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4339 1318 2086 2085 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4340 1319 2086 2087 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4341 1320 2088 2085 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4342 1321 2088 2095 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4343 1322 2315 2317 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4344 1323 2315 2316 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4345 1324 2995 2987 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4346 1325 226 215 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4347 1326 515 516 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4348 1327 2085 2084 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4349 1328 266 260 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4350 1329 576 582 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4351 1330 576 583 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4352 1331 576 573 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4353 1332 1985 1984 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4354 1333 2967 2987 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4355 1334 2967 2968 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4356 1335 281 278 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4357 1336 281 287 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4358 1337 2503 2512 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4359 1338 83 82 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4360 1339 83 84 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4361 1340 580 572 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4362 1341 559 548 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4363 1342 2331 2326 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4364 1343 2091 2102 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4365 1344 2091 2092 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4366 1345 264 256 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4367 1346 261 260 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4368 1347 261 262 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4369 1348 1991 1984 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4370 1349 540 531 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4371 1350 2068 2067 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4372 1351 2978 2970 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4373 1352 256 257 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4374 1353 73 72 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4375 1354 2056 2054 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4376 1355 2056 2057 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4377 1356 2970 2971 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4378 1357 2970 2979 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4379 1358 2987 2988 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4380 1359 215 225 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4381 1360 215 224 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4382 1361 82 85 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4383 1362 82 81 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4384 1363 581 573 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4385 1364 2981 2971 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4386 1365 476 489 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4387 1366 476 488 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4388 1367 1823 1813 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4389 1368 278 286 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4390 1369 278 277 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4391 1370 2062 2054 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4392 1371 2998 2991 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4393 1372 2326 2327 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4394 1373 2326 2328 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4395 1374 85 91 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4396 1375 85 87 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4397 1376 260 257 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4398 1377 260 267 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4399 1378 572 573 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4400 1379 572 550 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4401 1380 526 517 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4402 1381 1984 1992 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4403 1382 1984 1983 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4404 1383 513 531 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4405 1384 513 514 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4406 1385 285 277 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4407 1386 2990 2989 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4408 1387 573 574 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4409 1388 2980 2971 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4410 1389 1822 1812 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4411 1390 549 548 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4412 1391 549 550 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4413 1392 549 560 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4414 1393 2971 2972 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4415 1394 531 532 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4416 1395 2054 2053 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4417 1396 548 533 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4418 1397 2334 2328 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4419 1398 1950 1939 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4420 1399 78 74 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4421 1400 1929 1919 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4422 1401 542 535 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4423 1402 1949 1939 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4424 1403 2057 2055 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4425 1404 2997 2991 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4426 1405 2084 2067 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4427 1406 2084 2093 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4428 1407 2067 2066 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4429 1408 516 517 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4430 1409 516 518 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4431 1410 72 81 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4432 1411 72 71 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4433 1412 550 551 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4434 1413 257 265 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4435 1414 257 258 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4436 1415 277 272 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4437 1416 2327 2332 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4438 1417 1882 1877 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4439 1418 2991 2988 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4440 1419 2991 2992 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4441 1420 81 89 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4442 1421 1922 1931 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4443 1422 1922 1921 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4444 1423 79 74 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4445 1424 1990 1983 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4446 1425 1919 1921 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4447 1426 1919 1917 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4448 1427 2105 2092 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4449 1428 2988 2989 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4450 1429 2988 2996 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4451 1430 1813 1812 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4452 1431 1813 1811 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4453 1432 3013 3005 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4454 1433 2077 2070 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4455 1434 2092 2104 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4456 1435 2092 2103 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4457 1436 517 519 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4458 1437 1927 1917 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4459 1438 2328 2335 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4460 1439 2328 2333 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4461 1440 1947 1938 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4462 1441 545 536 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4463 1442 2989 3001 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4464 1443 544 536 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4465 1444 627 622 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4466 1445 1939 1938 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4467 1446 1939 1940 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4468 1447 2083 2072 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4469 1448 1926 1915 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4470 1449 1812 1810 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4471 1450 1921 1920 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4472 1451 1917 1916 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4473 1452 76 70 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4474 1453 74 71 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4475 1454 74 75 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4476 1455 96 87 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4477 1456 1983 1989 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4478 1457 1983 1980 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4479 1458 2076 2069 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4480 1459 527 518 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4481 1460 628 623 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4482 1461 87 94 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4483 1462 87 95 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4484 1463 535 532 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4485 1464 535 536 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4486 1465 535 543 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4487 1466 533 532 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4488 1467 533 534 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4489 1468 532 541 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4490 1469 536 537 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4491 1470 2073 2065 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4492 1471 518 520 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4493 1472 258 259 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4494 1473 258 270 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4495 1474 3000 2994 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4496 1475 1880 1874 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4497 1476 1920 1930 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4498 1477 1920 1918 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4499 1478 2053 2055 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4500 1479 2053 2052 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4501 1480 1916 1915 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4502 1481 1916 1918 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4503 1482 71 70 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4504 1483 71 77 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4505 1484 1938 1948 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4506 1485 1938 1937 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4507 1486 67 60 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4508 1487 574 575 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4509 1488 574 589 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4510 1489 1951 1940 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4511 1490 2081 2072 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4512 1491 274 270 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4513 1492 2972 2982 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4514 1493 2972 2983 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4515 1494 2972 2973 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4516 1495 1821 1811 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4517 1496 1982 1981 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4518 1497 2055 2063 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4519 1498 1877 1881 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4520 1499 1877 1874 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4521 1500 1877 1878 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4522 1501 1925 1915 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4523 1502 2072 2070 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4524 1503 2072 2082 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4525 1504 2070 2069 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4526 1505 2070 2071 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4527 1506 3011 3002 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4528 1507 80 75 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4529 1508 1915 1912 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4530 1509 70 58 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4531 1510 1811 1809 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4532 1511 596 589 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4533 1512 62 61 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4534 1513 622 621 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4535 1514 2066 2069 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4536 1515 2066 2065 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4537 1516 2066 2074 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4538 1517 1918 1928 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4539 1518 3005 3012 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4540 1519 3005 3002 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4541 1520 3005 3006 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4542 1521 270 271 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4543 1522 2059 2049 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4544 1523 3001 3002 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4545 1524 3001 3010 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4546 1525 272 273 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4547 1526 272 271 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4548 1527 1988 1980 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4549 1528 2069 2075 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4550 1529 602 595 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4551 1530 2992 2994 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4552 1531 2992 2993 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4553 1532 1940 1952 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4554 1533 1940 1953 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4555 1534 2065 2050 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4556 1535 626 621 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4557 1536 2986 2973 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4558 1537 1946 1937 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4559 1538 1883 1878 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4560 1539 519 528 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4561 1540 519 521 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4562 1541 3008 3006 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4563 1542 2994 2999 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4564 1543 65 57 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4565 1544 1980 1981 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4566 1545 1980 1979 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4567 1546 1810 1820 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4568 1547 1810 1807 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4569 1548 589 590 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4570 1549 623 621 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4571 1550 623 630 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4572 1551 623 629 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4573 1552 1942 1933 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4574 1553 3002 3003 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4575 1554 1874 1873 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4576 1555 1874 1875 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4577 1556 1981 1996 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4578 1557 2060 2052 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4579 1558 2973 2985 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4580 1559 2973 2984 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4581 1560 621 618 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4582 1561 3006 3007 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4583 1562 1937 1945 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4584 1563 1937 1936 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4585 1564 60 61 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4586 1565 60 57 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4587 1566 60 66 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4588 1567 2052 2049 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4589 1568 2052 2061 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4590 1569 271 276 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4591 1570 271 275 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4592 1571 61 63 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4593 1572 520 521 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4594 1573 520 529 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4595 1574 2078 2071 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4596 1575 1914 1913 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4597 1576 2049 2050 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4598 1577 2049 2048 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4599 1578 537 538 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4600 1579 537 539 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4601 1580 1879 1873 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4602 1581 2050 2051 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4603 1582 1876 1875 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4604 1583 2079 2071 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4605 1584 2071 2080 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4606 1585 58 57 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4607 1586 58 59 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4608 1587 2006 2000 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4609 1588 57 56 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4610 1589 1873 1868 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4611 1590 1846 1845 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4612 1591 595 601 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4613 1592 595 600 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4614 1593 595 593 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4615 1594 1002 991 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4616 1595 1913 1912 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4617 1596 1913 1932 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4618 1597 1809 1807 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4619 1598 1809 1808 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4620 1599 1781 1774 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4621 1600 521 530 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4622 1601 1912 1924 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4623 1602 1912 1911 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4624 1603 1000 990 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4625 1604 2044 2043 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4626 1605 1851 1844 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4627 1606 547 539 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4628 1607 1871 1867 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4629 1608 1987 1979 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4630 1609 2005 1997 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4631 1610 1932 1933 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4632 1611 1932 1941 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4633 1612 1933 1936 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4634 1613 1933 1934 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4635 1614 1807 1805 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4636 1615 624 617 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4637 1616 1864 1860 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4638 1617 1875 1884 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4639 1618 933 928 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4640 1619 610 603 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4641 1620 1979 1971 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4642 1621 1017 1012 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4643 1622 40 39 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4644 1623 964 959 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4645 1624 1827 1826 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4646 1625 965 959 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4647 1626 1996 1997 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4648 1627 1996 2004 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4649 1628 1865 1860 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4650 1629 539 546 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4651 1630 934 929 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4652 1631 1868 1869 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4653 1632 1868 1867 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4654 1633 1852 1847 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4655 1634 590 597 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4656 1635 590 593 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4657 1636 590 591 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4658 1637 1854 1848 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4659 1638 1936 1944 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4660 1639 1936 1943 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4661 1640 1001 990 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4662 1641 652 647 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4663 1642 966 960 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4664 1643 63 68 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4665 1644 63 69 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4666 1645 1845 1844 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4667 1646 1845 1859 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4668 1647 36 31 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4669 1648 3003 3004 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4670 1649 3003 3009 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4671 1650 594 593 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4672 1651 594 599 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4673 1652 990 991 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4674 1653 990 989 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4675 1654 593 598 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4676 1655 2000 1997 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4677 1656 2000 2001 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4678 1657 2000 2007 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4679 1658 991 1004 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4680 1659 991 1003 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4681 1660 2048 2043 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4682 1661 2048 2058 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4683 1662 959 960 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4684 1663 959 958 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4685 1664 651 646 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4686 1665 1867 1872 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4687 1666 1867 1866 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4688 1667 1997 1998 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4689 1668 618 617 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4690 1669 618 625 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4691 1670 618 619 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4692 1671 1860 1859 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4693 1672 1860 1861 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4694 1673 1935 1934 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4695 1674 2043 2042 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4696 1675 1844 1847 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4697 1676 1844 1843 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4698 1677 2002 2001 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4699 1678 34 30 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4700 1679 612 607 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4701 1680 927 926 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4702 1681 1774 1773 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4703 1682 1774 1783 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4704 1683 1774 1782 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4705 1684 1923 1911 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4706 1685 617 605 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4707 1686 929 928 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4708 1687 1808 1819 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4709 1688 1808 1806 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4710 1689 2001 2003 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4711 1690 879 872 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4712 1691 928 932 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4713 1692 928 925 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4714 1693 1773 1772 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4715 1694 1911 1897 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4716 1695 56 39 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4717 1696 56 64 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4718 1697 603 591 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4719 1698 603 604 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4720 1699 1012 1018 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4721 1700 1012 1010 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4722 1701 1934 1954 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4723 1702 39 38 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4724 1703 1859 1863 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4725 1704 1838 1830 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4726 1705 1978 1973 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4727 1706 1847 1848 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4728 1707 1847 1849 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4729 1708 960 967 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4730 1709 960 954 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4731 1710 1011 1010 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4732 1711 1971 1972 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4733 1712 1971 1970 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4734 1713 1884 1890 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4735 1714 1884 1885 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4736 1715 1834 1828 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4737 1716 864 852 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4738 1717 650 646 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4739 1718 1817 1804 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4740 1719 1826 1843 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4741 1720 1826 1825 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4742 1721 1125 1114 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4743 1722 1848 1853 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4744 1723 1848 1855 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4745 1724 647 646 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4746 1725 863 852 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4747 1726 2020 2010 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4748 1727 1805 1806 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4749 1728 1805 1804 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4750 1729 31 30 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4751 1730 591 592 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4752 1731 862 851 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4753 1732 2003 2009 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4754 1733 2003 2008 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4755 1734 646 643 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4756 1735 35 30 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4757 1736 1832 1824 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4758 1737 944 936 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4759 1738 619 620 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4760 1739 619 631 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4761 1740 30 27 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4762 1741 613 608 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4763 1742 876 871 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4764 1743 1010 1009 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4765 1744 1976 1973 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4766 1745 2045 2041 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4767 1746 877 872 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4768 1747 1843 1850 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4769 1748 946 940 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4770 1749 1815 1801 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4771 1750 2013 2012 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4772 1751 607 608 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4773 1752 607 604 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4774 1753 607 609 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4775 1754 1837 1830 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4776 1755 1126 1114 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4777 1756 926 925 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4778 1757 926 935 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4779 1758 931 925 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4780 1759 1891 1885 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4781 1760 852 851 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4782 1761 852 865 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4783 1762 871 870 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4784 1763 963 958 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4785 1764 1806 1818 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4786 1765 872 878 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4787 1766 872 870 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4788 1767 874 867 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4789 1768 1830 1828 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4790 1769 1830 1839 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4791 1770 1973 1970 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4792 1771 1973 1977 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4793 1772 1114 1113 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4794 1773 1866 1861 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4795 1774 1866 1870 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4796 1775 925 924 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4797 1776 958 962 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4798 1777 958 955 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4799 1778 950 941 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4800 1779 1861 1862 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4801 1780 48 41 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4802 1781 989 998 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4803 1782 989 999 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4804 1783 989 988 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4805 1784 604 605 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4806 1785 604 611 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4807 1786 605 606 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4808 1787 1998 2010 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4809 1788 1998 1999 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4810 1789 1804 1801 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4811 1790 1804 1816 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4812 1791 2042 2046 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4813 1792 2042 2041 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4814 1793 2042 2047 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4815 1794 1828 1825 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4816 1795 1828 1829 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4817 1796 2010 2011 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4818 1797 45 37 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4819 1798 1885 1886 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4820 1799 1885 1888 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4821 1800 1897 1898 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4822 1801 1897 1896 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4823 1802 1970 1969 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4824 1803 1970 1975 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4825 1804 1824 1825 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4826 1805 1824 1802 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4827 1806 1954 1963 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4828 1807 1954 1955 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4829 1808 2041 2029 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4830 1809 851 861 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4831 1810 851 850 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4832 1811 631 637 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4833 1812 631 632 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4834 1813 742 737 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4835 1814 1858 1849 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4836 1815 1825 1833 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4837 1816 859 850 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4838 1817 1974 1969 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4839 1818 1849 1856 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4840 1819 1849 1857 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4841 1820 2034 2028 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4842 1821 947 940 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4843 1822 1841 1831 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4844 1823 856 848 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4845 1824 38 37 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4846 1825 38 41 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4847 1826 38 46 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4848 1827 954 955 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4849 1828 954 937 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4850 1829 614 609 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4851 1830 1842 1831 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4852 1831 49 42 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4853 1832 1127 1115 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4854 1833 936 935 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4855 1834 936 937 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4856 1835 936 939 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4857 1836 37 28 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4858 1837 1801 1802 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4859 1838 1801 1800 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4860 1839 1778 1771 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4861 1840 1969 1956 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4862 1841 1074 1064 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4863 1842 935 943 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4864 1843 743 737 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4865 1844 870 867 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4866 1845 870 875 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4867 1846 1902 1895 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4868 1847 940 939 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4869 1848 940 942 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4870 1849 615 609 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4871 1850 1886 1887 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4872 1851 1886 1895 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4873 1852 1016 1009 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4874 1853 609 616 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4875 1854 996 988 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4876 1855 638 632 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4877 1856 1073 1064 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4878 1857 649 643 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4879 1858 648 642 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4880 1859 1772 1779 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4881 1860 1772 1771 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4882 1861 1772 1780 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4883 1862 951 942 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4884 1863 1895 1896 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4885 1864 643 642 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4886 1865 643 644 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4887 1866 2012 2011 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4888 1867 2012 2027 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4889 1868 41 42 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4890 1869 41 47 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4891 1870 1787 1786 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4892 1871 1893 1888 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4893 1872 1904 1899 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4894 1873 1015 1009 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4895 1874 642 633 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4896 1875 737 735 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4897 1876 27 28 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4898 1877 27 33 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4899 1878 27 26 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4900 1879 1802 1803 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4901 1880 1009 1006 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4902 1881 867 866 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4903 1882 867 868 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4904 1883 1095 1084 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4905 1884 28 29 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4906 1885 955 961 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4907 1886 955 956 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4908 1887 1831 1829 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4909 1888 1831 1840 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4910 1889 941 939 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4911 1890 941 948 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4912 1891 941 949 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4913 1892 850 860 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4914 1893 850 849 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4915 1894 1113 1115 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4916 1895 1113 1112 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4917 1896 1956 1957 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4918 1897 1956 1955 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4919 1898 1123 1111 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4920 1899 988 997 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4921 1900 988 987 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4922 1901 633 632 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4923 1902 633 634 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4924 1903 632 635 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4925 1904 1072 1063 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4926 1905 869 868 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4927 1906 937 938 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4928 1907 2023 2014 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4929 1908 855 848 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4930 1909 939 945 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4931 1910 1115 1128 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4932 1911 1771 1777 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4933 1912 1771 1768 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4934 1913 2029 2028 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4935 1914 2029 2030 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4936 1915 55 44 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4937 1916 1888 1892 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4938 1917 1888 1889 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4939 1918 1064 1075 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4940 1919 1064 1062 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4941 1920 1896 1899 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4942 1921 1896 1903 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4943 1922 2011 2014 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4944 1923 2011 2021 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4945 1924 42 44 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4946 1925 42 43 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4947 1926 924 930 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4948 1927 924 906 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4949 1928 1829 1836 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4950 1929 1829 1835 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4951 1930 2028 2027 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4952 1931 2028 2031 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4953 1932 1070 1063 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4954 1933 848 849 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4955 1934 848 845 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4956 1935 942 953 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4957 1936 942 952 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4958 1937 1955 1964 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4959 1938 1955 1958 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4960 1939 847 846 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4961 1940 1094 1083 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4962 1941 866 846 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4963 1942 866 873 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4964 1943 1906 1900 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4965 1944 1096 1084 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4966 1945 774 768 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4967 1946 2027 2033 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4968 1947 846 845 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4969 1948 1899 1900 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4970 1949 1899 1901 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4971 1950 1800 1786 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4972 1951 1800 1814 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4973 1952 868 880 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4974 1953 1786 1785 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4975 1954 773 768 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4976 1955 1084 1083 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4977 1956 1084 1097 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4978 1957 1063 1062 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4979 1958 1063 1071 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4980 1959 26 32 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4981 1960 26 21 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4982 1961 2014 2022 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4983 1962 2014 2015 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4984 1963 644 645 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4985 1964 644 653 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4986 1965 44 53 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4987 1966 44 54 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4988 1967 1112 1111 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4989 1968 1112 1124 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4990 1969 1111 1122 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4991 1970 1111 1110 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4992 1971 2025 2017 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4993 1972 849 857 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4994 1973 849 858 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4995 1974 51 43 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4996 1975 735 736 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4997 1976 735 734 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4998 1977 1910 1901 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
4999 1978 907 906 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5000 1979 994 987 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5001 1980 1791 1784 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5002 1981 2036 2031 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5003 1982 1083 1093 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5004 1983 1083 1082 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5005 1984 1900 1905 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5006 1985 1900 1907 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5007 1986 956 957 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5008 1987 956 968 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5009 1988 1006 1014 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5010 1989 1006 1005 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5011 1990 1006 1007 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5012 1991 1965 1958 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5013 1992 1068 1061 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5014 1993 845 854 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5015 1994 845 844 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5016 1995 768 775 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5017 1996 768 767 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5018 1997 906 905 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5019 1998 1889 1894 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5020 1999 1062 1061 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5021 2000 1062 1069 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5022 2001 987 995 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5023 2002 987 984 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5024 2003 43 50 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5025 2004 43 52 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5026 2005 2031 2035 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5027 2006 2031 2032 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5028 2007 668 659 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5029 2008 635 639 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5030 2009 635 640 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5031 2010 635 636 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5032 2011 782 781 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5033 2012 1013 1005 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5034 2013 741 734 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5035 2014 1761 1760 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5036 2015 1776 1768 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5037 2016 772 767 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5038 2017 1958 1966 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5039 2018 1958 1959 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5040 2019 1768 1769 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5041 2020 1768 1767 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5042 2021 1901 1908 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5043 2022 1901 1909 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5044 2023 21 22 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5045 2024 21 20 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5046 2025 1005 985 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5047 2026 819 815 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5048 2027 808 802 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5049 2028 809 802 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5050 2029 667 659 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5051 2030 1008 1007 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5052 2031 1784 1785 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5053 2032 1784 1769 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5054 2033 807 799 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5055 2034 740 734 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5056 2035 2039 2033 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5057 2036 660 653 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5058 2037 992 983 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5059 2038 653 654 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5060 2039 734 731 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5061 2040 1499 1492 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5062 2041 24 20 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5063 2042 2017 2015 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5064 2043 2017 2019 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5065 2044 2033 2040 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5066 2045 2033 2032 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5067 2046 1120 1110 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5068 2047 880 894 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5069 2048 880 881 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5070 2049 2015 2016 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5071 2050 977 968 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5072 2051 771 764 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5073 2052 985 986 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5074 2053 985 984 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5075 2054 1785 1792 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5076 2055 1785 1788 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5077 2056 1061 1067 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5078 2057 1061 1058 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5079 2058 1769 1770 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5080 2059 1110 1121 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5081 2060 1110 1109 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5082 2061 1087 1080 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5083 2062 1007 1019 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5084 2063 1795 1789 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5085 2064 1762 1760 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5086 2065 1500 1492 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5087 2066 1066 1058 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5088 2067 659 666 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5089 2068 659 657 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5090 2069 767 764 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5091 2070 767 769 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5092 2071 968 969 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5093 2072 787 779 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5094 2073 802 799 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5095 2074 802 803 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5096 2075 636 641 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5097 2076 1775 1767 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5098 2077 1793 1788 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5099 2078 1760 1759 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5100 2079 1091 1082 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5101 2080 1968 1959 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5102 2081 776 769 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5103 2082 984 983 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5104 2083 984 993 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5105 2084 1079 1078 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5106 2085 1767 1757 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5107 2086 804 805 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5108 2087 804 803 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5109 2088 844 853 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5110 2089 844 824 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5111 2090 812 805 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5112 2091 20 25 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5113 2092 20 19 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5114 2093 883 882 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5115 2094 1085 1076 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5116 2095 983 970 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5117 2096 1082 1092 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5118 2097 1082 1081 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5119 2098 821 816 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5120 2099 799 800 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5121 2100 799 798 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5122 2101 2032 2037 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5123 2102 2032 2038 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5124 2103 815 816 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5125 2104 815 800 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5126 2105 1492 1501 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5127 2106 1492 1491 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5128 2107 882 904 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5129 2108 882 881 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5130 2109 1959 1967 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5131 2110 1959 1960 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5132 2111 813 805 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5133 2112 895 881 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5134 2113 905 904 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5135 2114 905 908 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5136 2115 905 916 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5137 2116 781 798 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5138 2117 781 780 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5139 2118 789 783 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5140 2119 1038 1026 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5141 2120 1035 1024 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5142 2121 904 915 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5143 2122 1788 1789 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5144 2123 1788 1790 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5145 2124 1058 1059 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5146 2125 1058 1057 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5147 2126 881 884 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5148 2127 747 746 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5149 2128 764 765 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5150 2129 764 763 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5151 2130 661 654 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5152 2131 805 814 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5153 2132 917 908 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5154 2133 769 778 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5155 2134 769 777 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5156 2135 1042 1029 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5157 2136 1090 1081 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5158 2137 1789 1794 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5159 2138 1789 1796 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5160 2139 654 657 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5161 2140 654 655 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5162 2141 779 780 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5163 2142 779 765 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5164 2143 1076 1059 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5165 2144 1076 1077 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5166 2145 1766 1759 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5167 2146 23 19 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5168 2147 2019 2018 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5169 2148 818 817 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5170 2149 793 785 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5171 2150 1080 1081 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5172 2151 1080 1088 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5173 2152 1080 1077 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5174 2153 1498 1491 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5175 2154 918 908 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5176 2155 13 6 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5177 2156 816 817 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5178 2157 816 820 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5179 2158 1118 1109 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5180 2159 1019 1030 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5181 2160 1019 1020 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5182 2161 1104 1099 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5183 2162 2016 2024 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5184 2163 2016 2018 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5185 2164 803 811 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5186 2165 803 810 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5187 2166 800 801 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5188 2167 731 739 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5189 2168 731 730 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5190 2169 731 732 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5191 2170 1081 1089 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5192 2171 908 909 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5193 2172 1109 1119 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5194 2173 1109 1106 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5195 2174 1757 1758 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5196 2175 1757 1756 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5197 2176 798 806 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5198 2177 14 6 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5199 2178 657 662 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5200 2179 657 658 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5201 2180 1078 1077 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5202 2181 1078 1098 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5203 2182 1059 1060 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5204 2183 738 730 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5205 2184 1502 1493 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5206 2185 970 969 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5207 2186 970 971 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5208 2187 824 825 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5209 2188 824 823 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5210 2189 19 3 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5211 2190 1759 1765 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5212 2191 1759 1756 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5213 2192 969 978 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5214 2193 969 972 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5215 2194 817 822 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5216 2195 780 783 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5217 2196 780 788 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5218 2197 796 786 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5219 2198 1491 1493 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5220 2199 1491 1490 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5221 2200 765 766 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5222 2201 1077 1086 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5223 2202 783 785 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5224 2203 783 784 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5225 2204 12 5 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5226 2205 752 744 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5227 2206 1101 1100 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5228 2207 746 763 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5229 2208 746 745 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5230 2209 1026 1025 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5231 2210 1026 1027 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5232 2211 1024 1034 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5233 2212 1024 1025 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5234 2213 1024 1023 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5235 2214 730 715 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5236 2215 841 830 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5237 2216 763 770 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5238 2217 6 5 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5239 2218 6 15 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5240 2219 1031 1020 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5241 2220 1057 1065 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5242 2221 1057 1045 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5243 2222 1960 1961 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5244 2223 1960 1962 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5245 2224 785 792 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5246 2225 785 794 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5247 2226 2018 2026 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5248 2227 979 972 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5249 2228 1552 1545 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5250 2229 655 656 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5251 2230 655 669 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5252 2231 1799 1790 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5253 2232 1029 1027 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5254 2233 1029 1041 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5255 2234 665 658 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5256 2235 1215 1204 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5257 2236 1790 1797 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5258 2237 1790 1798 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5259 2238 732 744 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5260 2239 732 733 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5261 2240 1100 1099 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5262 2241 1100 1105 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5263 2242 822 831 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5264 2243 822 823 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5265 2244 744 745 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5266 2245 1099 1098 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5267 2246 1099 1103 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5268 2247 1756 1764 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5269 2248 1756 1755 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5270 2249 1493 1503 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5271 2250 1493 1504 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5272 2251 1020 1023 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5273 2252 1020 1021 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5274 2253 1037 1025 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5275 2254 16 7 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5276 2255 884 896 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5277 2256 884 897 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5278 2257 884 885 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5279 2258 840 829 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5280 2259 1496 1490 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5281 2260 1555 1546 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5282 2261 1098 1102 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5283 2262 1046 1045 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5284 2263 1032 1023 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5285 2264 1025 1036 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5286 2265 972 980 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5287 2266 972 973 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5288 2267 658 663 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5289 2268 658 664 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5290 2269 5 7 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5291 2270 5 2 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5292 2271 842 830 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5293 2272 900 890 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5294 2273 678 669 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5295 2274 1105 1106 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5296 2275 1105 1116 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5297 2276 1027 1028 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5298 2277 791 784 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5299 2278 1106 1117 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5300 2279 1106 1107 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5301 2280 1023 1033 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5302 2281 823 832 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5303 2282 823 826 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5304 2283 786 784 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5305 2284 786 797 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5306 2285 786 795 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5307 2286 919 910 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5308 2287 1045 1044 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5309 2288 669 670 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5310 2289 830 829 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5311 2290 830 843 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5312 2291 723 714 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5313 2292 1490 1497 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5314 2293 1490 1487 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5315 2294 784 790 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5316 2295 3 4 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5317 2296 3 2 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5318 2297 909 910 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5319 2298 909 911 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5320 2299 1214 1204 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5321 2300 834 826 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5322 2301 745 753 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5323 2302 745 748 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5324 2303 1154 1153 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5325 2304 715 716 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5326 2305 715 714 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5327 2306 1204 1213 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5328 2307 1204 1202 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5329 2308 1554 1545 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5330 2309 7 18 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5331 2310 7 17 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5332 2311 1545 1553 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5333 2312 1545 1544 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5334 2313 676 675 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5335 2314 829 839 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5336 2315 829 828 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5337 2316 1160 1155 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5338 2317 679 670 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5339 2318 1208 1201 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5340 2319 755 748 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5341 2320 920 911 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5342 2321 680 673 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5343 2322 1763 1755 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5344 2323 890 887 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5345 2324 890 892 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5346 2325 1556 1546 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5347 2326 910 912 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5348 2327 1546 1544 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5349 2328 1546 1557 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5350 2329 885 887 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5351 2330 885 886 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5352 2331 1755 1741 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5353 2332 835 827 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5354 2333 756 749 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5355 2334 826 827 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5356 2335 826 833 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5357 2336 714 713 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5358 2337 714 717 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5359 2338 1050 1044 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5360 2339 2 11 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5361 2340 2 1 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5362 2341 1021 1022 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5363 2342 1021 1043 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5364 2343 10 1 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5365 2344 694 693 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5366 2345 902 892 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5367 2346 670 673 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5368 2347 670 671 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5369 2348 702 695 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5370 2349 911 913 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5371 2350 725 717 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5372 2351 1750 1744 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5373 2352 1751 1744 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5374 2353 887 889 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5375 2354 748 749 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5376 2355 748 754 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5377 2356 1153 1155 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5378 2357 1153 1152 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5379 2358 982 973 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5380 2359 1044 1043 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5381 2360 1044 1047 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5382 2361 973 981 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5383 2362 973 974 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5384 2363 1028 1040 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5385 2364 1028 1039 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5386 2365 1155 1161 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5387 2366 726 718 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5388 2367 1107 1129 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5389 2368 1107 1108 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5390 2369 1544 1551 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5391 2370 1544 1543 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5392 2371 1137 1129 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5393 2372 1495 1487 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5394 2373 892 893 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5395 2374 1157 1149 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5396 2375 706 697 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5397 2376 675 677 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5398 2377 675 674 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5399 2378 1207 1201 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5400 2379 1487 1486 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5401 2380 1487 1488 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5402 2381 1132 1131 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5403 2382 827 828 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5404 2383 827 836 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5405 2384 1205 1197 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5406 2385 673 674 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5407 2386 673 681 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5408 2387 898 886 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5409 2388 1201 1202 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5410 2389 1201 1198 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5411 2390 1165 1164 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5412 2391 886 888 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5413 2392 1494 1486 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5414 2393 1043 1049 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5415 2394 762 751 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5416 2395 1 8 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5417 2396 1 9 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5418 2397 693 713 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5419 2398 693 692 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5420 2399 1202 1209 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5421 2400 1202 1203 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5422 2401 713 722 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5423 2402 717 718 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5424 2403 717 724 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5425 2404 1200 1199 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5426 2405 749 751 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5427 2406 749 750 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5428 2407 1744 1749 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5429 2408 1744 1743 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5430 2409 707 697 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5431 2410 1170 1162 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5432 2411 1129 1130 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5433 2412 828 838 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5434 2413 828 837 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5435 2414 1195 1187 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5436 2415 1193 1186 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5437 2416 682 674 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5438 2417 1189 1182 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5439 2418 703 695 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5440 2419 700 691 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5441 2420 1741 1742 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5442 2421 1741 1740 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5443 2422 695 692 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5444 2423 695 696 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5445 2424 975 974 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5446 2425 1159 1152 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5447 2426 674 683 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5448 2427 718 719 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5449 2428 718 727 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5450 2429 912 921 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5451 2430 912 914 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5452 2431 1486 1477 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5453 2432 758 750 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5454 2433 697 696 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5455 2434 697 698 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5456 2435 671 672 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5457 2436 671 684 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5458 2437 974 976 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5459 2438 889 888 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5460 2439 889 891 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5461 2440 1051 1047 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5462 2441 1152 1149 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5463 2442 1152 1158 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5464 2443 729 721 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5465 2444 751 760 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5466 2445 751 761 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5467 2446 1131 1148 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5468 2447 1131 1130 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5469 2448 893 903 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5470 2449 893 891 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5471 2450 1149 1148 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5472 2451 1149 1150 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5473 2452 1512 1510 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5474 2453 1488 1489 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5475 2454 1488 1505 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5476 2455 1513 1505 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5477 2456 888 899 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5478 2457 1197 1198 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5479 2458 1197 1183 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5480 2459 913 914 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5481 2460 913 922 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5482 2461 1047 1052 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5483 2462 1047 1048 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5484 2463 692 691 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5485 2464 692 701 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5486 2465 709 698 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5487 2466 1550 1543 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5488 2467 1747 1740 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5489 2468 719 721 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5490 2469 719 720 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5491 2470 721 728 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5492 2471 1198 1199 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5493 2472 1198 1206 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5494 2473 1056 1049 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5495 2474 691 686 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5496 2475 1212 1203 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5497 2476 1173 1166 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5498 2477 688 684 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5499 2478 750 757 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5500 2479 750 759 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5501 2480 1199 1216 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5502 2481 1543 1549 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5503 2482 1543 1540 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5504 2483 1162 1150 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5505 2484 1162 1163 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5506 2485 1179 1169 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5507 2486 1164 1163 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5508 2487 1164 1181 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5509 2488 1505 1506 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5510 2489 1203 1210 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5511 2490 1203 1211 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5512 2491 1538 1533 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5513 2492 1187 1194 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5514 2493 1187 1196 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5515 2494 1187 1185 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5516 2495 891 901 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5517 2496 1049 1048 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5518 2497 1049 1055 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5519 2498 1053 1048 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5520 2499 1186 1191 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5521 2500 1186 1192 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5522 2501 1186 1185 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5523 2502 696 705 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5524 2503 696 704 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5525 2504 1148 1156 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5526 2505 684 685 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5527 2506 1182 1183 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5528 2507 1182 1185 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5529 2508 1182 1181 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5530 2509 914 923 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5531 2510 1130 1138 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5532 2511 1130 1133 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5533 2512 1740 1743 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5534 2513 1740 1739 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5535 2514 1223 1217 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5536 2515 1250 1237 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5537 2516 1511 1510 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5538 2517 1482 1476 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5539 2518 1610 1605 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5540 2519 1743 1748 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5541 2520 1743 1745 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5542 2521 1139 1133 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5543 2522 1510 1509 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5544 2523 698 708 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5545 2524 698 699 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5546 2525 1514 1506 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5547 2526 711 699 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5548 2527 1180 1169 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5549 2528 1548 1540 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5550 2529 1249 1237 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5551 2530 1048 1054 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5552 2531 1150 1151 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5553 2532 1483 1479 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5554 2533 1245 1233 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5555 2534 1237 1235 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5556 2535 1536 1533 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5557 2536 1224 1220 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5558 2537 1477 1476 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5559 2538 1477 1478 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5560 2539 1183 1184 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5561 2540 1258 1257 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5562 2541 1185 1190 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5563 2542 1244 1233 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5564 2543 1753 1745 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5565 2544 1141 1134 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5566 2545 1163 1166 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5567 2546 1163 1171 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5568 2547 1181 1188 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5569 2548 1169 1178 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5570 2549 1169 1167 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5571 2550 1609 1604 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5572 2551 1533 1537 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5573 2552 1533 1530 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5574 2553 1166 1172 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5575 2554 1166 1167 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5576 2555 1547 1539 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5577 2556 1506 1509 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5578 2557 1506 1507 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5579 2558 1259 1257 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5580 2559 1133 1134 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5581 2560 1133 1135 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5582 2561 1235 1234 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5583 2562 1235 1236 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5584 2563 1146 1136 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5585 2564 1540 1539 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5586 2565 1540 1541 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5587 2566 1216 1217 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5588 2567 1216 1222 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5589 2568 1257 1256 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5590 2569 1247 1236 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5591 2570 699 712 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5592 2571 699 710 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5593 2572 1476 1479 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5594 2573 1476 1475 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5595 2574 1234 1246 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5596 2575 1234 1233 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5597 2576 1217 1220 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5598 2577 1217 1218 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5599 2578 686 685 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5600 2579 686 687 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5601 2580 1745 1752 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5602 2581 1745 1754 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5603 2582 1236 1248 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5604 2583 1265 1256 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5605 2584 1233 1232 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5606 2585 1238 1227 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5607 2586 1177 1168 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5608 2587 1720 1719 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5609 2588 685 690 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5610 2589 685 689 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5611 2590 1539 1531 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5612 2591 1509 1515 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5613 2592 1509 1516 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5614 2593 1220 1221 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5615 2594 1220 1225 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5616 2595 1279 1272 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5617 2596 1605 1612 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5618 2597 1605 1611 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5619 2598 1605 1603 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5620 2599 1479 1484 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5621 2600 1479 1480 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5622 2601 1221 1226 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5623 2602 1134 1136 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5624 2603 1134 1140 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5625 2604 1240 1231 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5626 2605 1739 1719 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5627 2606 1739 1746 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5628 2607 1399 1391 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5629 2608 1143 1135 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5630 2609 1167 1168 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5631 2610 1167 1174 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5632 2611 1346 1341 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5633 2612 1608 1603 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5634 2613 1604 1603 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5635 2614 1282 1273 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5636 2615 1256 1264 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5637 2616 1256 1255 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5638 2617 1262 1255 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5639 2618 1136 1145 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5640 2619 1136 1147 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5641 2620 1719 1718 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5642 2621 1382 1378 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5643 2622 1534 1529 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5644 2623 1531 1530 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5645 2624 1531 1532 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5646 2625 1454 1453 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5647 2626 1380 1375 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5648 2627 1393 1391 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5649 2628 1393 1392 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5650 2629 1135 1142 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5651 2630 1135 1144 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5652 2631 1168 1175 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5653 2632 1168 1176 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5654 2633 1227 1218 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5655 2634 1227 1228 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5656 2635 1603 1600 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5657 2636 1507 1508 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5658 2637 1507 1517 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5659 2638 1530 1529 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5660 2639 1530 1535 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5661 2640 1475 1453 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5662 2641 1475 1481 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5663 2642 1243 1232 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5664 2643 1260 1251 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5665 2644 1480 1485 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5666 2645 1278 1271 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5667 2646 1218 1219 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5668 2647 1391 1389 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5669 2648 1541 1542 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5670 2649 1541 1558 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5671 2650 1344 1340 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5672 2651 1232 1231 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5673 2652 1232 1242 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5674 2653 1272 1280 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5675 2654 1272 1271 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5676 2655 1272 1281 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5677 2656 1347 1341 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5678 2657 1373 1368 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5679 2658 1370 1369 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5680 2659 1448 1444 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5681 2660 1529 1519 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5682 2661 1231 1228 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5683 2662 1231 1241 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5684 2663 1381 1378 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5685 2664 1525 1517 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5686 2665 1255 1263 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5687 2666 1255 1252 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5688 2667 1453 1452 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5689 2668 1341 1340 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5690 2669 1341 1342 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5691 2670 1345 1340 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5692 2671 1378 1375 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5693 2672 1378 1383 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5694 2673 1443 1442 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5695 2674 1517 1518 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5696 2675 1273 1271 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5697 2676 1273 1284 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5698 2677 1273 1283 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5699 2678 1689 1680 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5700 2679 1353 1352 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5701 2680 1394 1384 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5702 2681 1271 1270 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5703 2682 1340 1337 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5704 2683 1375 1374 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5705 2684 1375 1376 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5706 2685 1567 1558 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5707 2686 1369 1374 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5708 2687 1369 1368 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5709 2688 1621 1619 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5710 2689 1228 1229 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5711 2690 1228 1239 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5712 2691 1251 1252 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5713 2692 1251 1229 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5714 2693 1435 1427 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5715 2694 1558 1559 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5716 2695 1392 1400 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5717 2696 1392 1390 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5718 2697 1374 1379 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5719 2698 1727 1718 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5720 2699 1729 1721 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5721 2700 1602 1601 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5722 2701 1446 1440 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5723 2702 1368 1372 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5724 2703 1368 1367 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5725 2704 1718 1721 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5726 2705 1718 1717 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5727 2706 1696 1695 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5728 2707 1404 1403 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5729 2708 1606 1599 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5730 2709 1463 1452 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5731 2710 1349 1342 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5732 2711 1274 1266 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5733 2712 1450 1445 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5734 2713 1444 1449 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5735 2714 1444 1445 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5736 2715 1444 1441 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5737 2716 1389 1390 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5738 2717 1389 1388 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5739 2718 1396 1388 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5740 2719 1600 1607 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5741 2720 1600 1601 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5742 2721 1600 1599 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5743 2722 1519 1518 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5744 2723 1519 1520 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5745 2724 1687 1680 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5746 2725 1252 1261 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5747 2726 1252 1253 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5748 2727 1442 1451 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5749 2728 1442 1441 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5750 2729 1691 1681 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5751 2730 1434 1427 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5752 2731 1466 1456 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5753 2732 1229 1230 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5754 2733 1342 1348 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5755 2734 1342 1336 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5756 2735 1680 1688 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5757 2736 1680 1679 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5758 2737 1452 1451 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5759 2738 1452 1455 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5760 2739 1467 1456 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5761 2740 1430 1422 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5762 2741 1706 1705 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5763 2742 1412 1401 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5764 2743 1384 1376 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5765 2744 1384 1385 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5766 2745 1414 1405 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5767 2746 1436 1427 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5768 2747 1427 1426 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5769 2748 1721 1728 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5770 2749 1721 1722 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5771 2750 1518 1526 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5772 2751 1518 1521 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5773 2752 1416 1407 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5774 2753 1352 1367 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5775 2754 1352 1351 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5776 2755 1527 1521 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5777 2756 1685 1678 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5778 2757 1717 1705 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5779 2758 1717 1726 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5780 2759 1601 1613 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5781 2760 1376 1377 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5782 2761 1619 1620 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5783 2762 1619 1618 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5784 2763 1579 1566 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5785 2764 1599 1582 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5786 2765 1440 1441 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5787 2766 1440 1423 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5788 2767 1390 1398 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5789 2768 1451 1462 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5790 2769 1677 1676 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5791 2770 1276 1270 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5792 2771 1266 1253 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5793 2772 1266 1267 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5794 2773 1572 1563 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5795 2774 1441 1447 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5796 2775 1270 1277 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5797 2776 1270 1267 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5798 2777 1388 1385 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5799 2778 1388 1397 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5800 2779 1362 1354 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5801 2780 1705 1704 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5802 2781 1699 1694 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5803 2782 1337 1338 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5804 2783 1337 1336 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5805 2784 1337 1343 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5806 2785 1456 1455 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5807 2786 1456 1457 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5808 2787 1367 1371 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5809 2788 1568 1559 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5810 2789 1591 1584 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5811 2790 1588 1580 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5812 2791 1253 1254 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5813 2792 1598 1587 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5814 2793 1559 1560 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5815 2794 1559 1562 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5816 2795 1690 1681 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5817 2796 1626 1618 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5818 2797 1363 1355 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5819 2798 1695 1694 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5820 2799 1695 1703 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5821 2800 1681 1679 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5822 2801 1681 1692 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5823 2802 1403 1402 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5824 2803 1403 1421 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5825 2804 1359 1350 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5826 2805 1338 1350 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5827 2806 1338 1339 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5828 2807 1521 1522 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5829 2808 1521 1528 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5830 2809 1712 1704 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5831 2810 1350 1351 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5832 2811 1469 1457 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5833 2812 1401 1402 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5834 2813 1401 1386 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5835 2814 1422 1423 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5836 2815 1422 1421 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5837 2816 1422 1425 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5838 2817 1336 1324 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5839 2818 1385 1386 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5840 2819 1385 1395 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5841 2820 1455 1464 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5842 2821 1455 1465 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5843 2822 1679 1678 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5844 2823 1679 1686 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5845 2824 1405 1415 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5846 2825 1405 1402 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5847 2826 1405 1406 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5848 2827 1267 1275 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5849 2828 1267 1268 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5850 2829 1407 1406 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5851 2830 1407 1409 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5852 2831 1566 1577 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5853 2832 1566 1578 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5854 2833 1566 1565 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5855 2834 1694 1693 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5856 2835 1694 1697 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5857 2836 1580 1560 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5858 2837 1580 1581 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5859 2838 1678 1675 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5860 2839 1678 1684 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5861 2840 1676 1693 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5862 2841 1676 1675 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5863 2842 1730 1722 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5864 2843 1618 1627 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5865 2844 1618 1617 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5866 2845 1423 1424 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5867 2846 1351 1354 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5868 2847 1351 1360 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5869 2848 1431 1425 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5870 2849 1683 1675 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5871 2850 1418 1409 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5872 2851 1457 1458 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5873 2852 1457 1468 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5874 2853 1704 1703 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5875 2854 1704 1707 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5876 2855 1571 1563 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5877 2856 1563 1562 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5878 2857 1563 1564 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5879 2858 1354 1355 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5880 2859 1354 1361 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5881 2860 1470 1458 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5882 2861 1357 1356 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5883 2862 1722 1723 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5884 2863 1722 1731 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5885 2864 1560 1561 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5886 2865 1402 1413 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5887 2866 1524 1522 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5888 2867 1426 1433 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5889 2868 1426 1425 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5890 2869 1426 1428 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5891 2870 1733 1723 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5892 2871 1582 1581 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5893 2872 1582 1583 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5894 2873 1421 1429 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5895 2874 1569 1562 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5896 2875 1458 1459 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5897 2876 1613 1614 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5898 2877 1613 1622 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5899 2878 1703 1711 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5900 2879 1355 1356 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5901 2880 1355 1364 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5902 2881 1562 1570 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5903 2882 1474 1461 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5904 2883 1522 1523 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5905 2884 1584 1581 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5906 2885 1584 1590 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5907 2886 1584 1585 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5908 2887 1623 1614 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5909 2888 1425 1432 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5910 2889 1693 1698 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5911 2890 1386 1387 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5912 2891 1675 1674 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5913 2892 1587 1597 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5914 2893 1587 1596 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5915 2894 1587 1585 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5916 2895 1356 1358 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5917 2896 1459 1461 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5918 2897 1459 1460 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5919 2898 1329 1323 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5920 2899 1461 1473 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5921 2900 1592 1585 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5922 2901 1406 1408 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5923 2902 1700 1697 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5924 2903 1409 1411 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5925 2904 1581 1589 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5926 2905 1472 1460 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5927 2906 1460 1471 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5928 2907 1723 1732 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5929 2908 1723 1724 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5930 2909 1614 1617 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5931 2910 1614 1615 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5932 2911 1575 1565 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5933 2912 1585 1586 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5934 2913 1697 1701 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5935 2914 1697 1702 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5936 2915 1358 1365 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5937 2916 1358 1366 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5938 2917 1331 1326 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5939 2918 1574 1564 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5940 2919 1324 1323 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5941 2920 1324 1325 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5942 2921 1565 1564 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5943 2922 1565 1576 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5944 2923 1437 1428 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5945 2924 1564 1573 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5946 2925 1617 1625 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5947 2926 1617 1624 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5948 2927 1428 1438 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5949 2928 1428 1439 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5950 2929 1268 1269 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5951 2930 1268 1285 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5952 2931 1323 1326 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5953 2932 1323 1322 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5954 2933 1707 1714 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5955 2934 1707 1713 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5956 2935 1707 1708 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5957 2936 1310 1309 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5958 2937 1330 1326 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5959 2938 1326 1327 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5960 2939 1709 1708 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5961 2940 1411 1420 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5962 2941 1411 1410 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5963 2942 1408 1417 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5964 2943 1408 1410 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5965 2944 1662 1661 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5966 2945 1674 1682 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5967 2946 1674 1661 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5968 2947 1738 1725 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5969 2948 1294 1285 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5970 2949 1734 1724 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5971 2950 1724 1725 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5972 2951 1724 1735 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5973 2952 1708 1710 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5974 2953 1285 1286 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5975 2954 1615 1616 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5976 2955 1615 1628 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5977 2956 1637 1628 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5978 2957 1586 1593 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5979 2958 1586 1594 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5980 2959 1586 1595 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5981 2960 1309 1322 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5982 2961 1309 1308 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5983 2962 1322 1328 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5984 2963 1661 1660 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5985 2964 1410 1419 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5986 2965 1316 1307 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5987 2966 1725 1737 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5988 2967 1725 1736 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5989 2968 1628 1629 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5990 2969 1672 1664 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5991 2970 1298 1290 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5992 2971 1320 1312 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5993 2972 1333 1327 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5994 2973 1327 1328 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5995 2974 1327 1332 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5996 2975 1631 1630 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5997 2976 1303 1292 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5998 2977 1307 1308 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
5999 2978 1307 1287 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6000 2979 1710 1716 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6001 2980 1710 1715 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6002 2981 1328 1334 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6003 2982 1328 1335 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6004 2983 1286 1295 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6005 2984 1286 1287 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6006 2985 1286 1289 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6007 2986 1308 1317 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6008 2987 1308 1311 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6009 2988 1671 1663 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6010 2989 1302 1292 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6011 2990 1299 1290 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6012 2991 1290 1289 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6013 2992 1290 1291 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6014 2993 1639 1632 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6015 2994 1664 1663 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6016 2995 1664 1665 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6017 2996 1664 1673 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6018 2997 1660 1663 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6019 2998 1660 1669 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6020 2999 1660 1659 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6021 3000 1667 1665 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6022 3001 1312 1321 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6023 3002 1312 1313 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6024 3003 1312 1311 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6025 3004 1287 1288 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6026 3005 1630 1629 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6027 3006 1630 1645 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6028 3007 1292 1291 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6029 3008 1292 1293 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6030 3009 1629 1632 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6031 3010 1629 1638 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6032 3011 1663 1670 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6033 3012 1665 1666 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6034 3013 1296 1289 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6035 3014 1648 1647 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6036 3015 1289 1297 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6037 3016 1315 1313 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6038 3017 1313 1314 ar
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6039 3018 1304 1293 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6040 3019 1659 1647 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6041 3020 1659 1668 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6042 3021 1311 1318 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6043 3022 1311 1319 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6044 3023 1642 1633 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6045 3024 1632 1640 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6046 3025 1632 1633 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6047 3026 1291 1300 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6048 3027 1291 1301 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6049 3028 1647 1646 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6050 3029 1293 1305 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6051 3030 1293 1306 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6052 3031 1645 1646 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6053 3032 1645 1651 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6054 3033 1652 1646 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6055 3034 1633 1641 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6056 3035 1633 1634 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6057 3036 1646 1649 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6058 3037 1658 1651 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6059 3038 1634 1635 2
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6060 3039 1634 1636 am
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6061 3040 1644 1636 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6062 3041 1651 1657 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6063 3042 1651 1650 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6064 3043 1636 1643 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6065 3044 1653 1649 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6066 3045 1649 1650 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6067 3046 1649 1654 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6068 3047 1650 1655 1
e99f861ba68a "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
bgruening
parents:
diff changeset
6069 3048 1650 1656 1