Mercurial > repos > chemteam > mdanalysis_endtoend
comparison macros.xml @ 0:78aa3659fcd1 draft
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit 1b23e024af45cc0999d9142d07de6897d4189ec2"
author | chemteam |
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date | Mon, 24 Aug 2020 16:47:23 -0400 |
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-1:000000000000 | 0:78aa3659fcd1 |
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1 <macros> | |
2 <token name="@TOOL_VERSION@">1.0.0</token> | |
3 <xml name="requirements"> | |
4 <requirements> | |
5 <requirement type="package" version="@TOOL_VERSION@">mdanalysis</requirement> | |
6 <yield/> | |
7 </requirements> | |
8 </xml> | |
9 <xml name="analysis_inputs"> | |
10 <param format="dcd,xtc" name="trajin" type="data" label="DCD/XTC trajectory input" /> | |
11 <param format="pdb,gro" name="strin" type="data" label="PDB/GRO input" /> | |
12 <yield/> | |
13 </xml> | |
14 <xml name="sanitizer"> | |
15 <sanitizer invalid_char=""> | |
16 <valid initial="string.ascii_letters,string.digits" /> | |
17 </sanitizer> | |
18 <yield/> | |
19 </xml> | |
20 <xml name="sanitizer_resids"> | |
21 <sanitizer invalid_char=""> | |
22 <valid initial="string.digits" /> | |
23 </sanitizer> | |
24 <yield/> | |
25 </xml> | |
26 <xml name="tests_inputs"> | |
27 <param name="trajin" value="test.dcd" ftype="dcd" /> | |
28 <param name="strin" value="test.pdb" ftype="pdb" /> | |
29 <yield/> | |
30 </xml> | |
31 <xml name="tests_inputs_gmx"> | |
32 <param name="trajin" value="test.xtc" ftype="xtc" /> | |
33 <param name="strin" value="test.gro" ftype="gro" /> | |
34 <yield/> | |
35 </xml> | |
36 <xml name="citations"> | |
37 <citations> | |
38 <citation type="doi">10.1093/bioinformatics/btz107</citation> | |
39 <citation type="doi">10.1002/jcc.21787</citation> | |
40 <yield/> | |
41 </citations> | |
42 </xml> | |
43 </macros> |