Mercurial > repos > bgruening > split_file_to_collection

annotate test-data/mol_1.sdf @ 8:6cbe2f30c2d7 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/tools/text_processing/split_file_to_collection commit a1f1f00463f734ba43f4e5c13c63fe5297ee128e-dirty"
author bgruening
date Sun, 12 Jul 2020 10:27:06 -0400
parents 0850f2dfba13
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
4
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
1 2244
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
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2 OpenBabel09021316243D
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
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3
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
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diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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27 1 12 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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35 6 11 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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36 7 9 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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38 8 10 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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39 8 15 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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40 9 10 2 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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41 9 16 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
44 13 18 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
46 13 20 1 0 0 0 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
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diff changeset
47 M END
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
51 > <PUBCHEM_CONFORMER_RMSD>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
54 > <PUBCHEM_CONFORMER_DIVERSEORDER>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
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0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
85 2 -0.65
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
86 21 0.5
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
87 3 -0.57
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
88 4 -0.57
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
89 5 0.08
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
90 6 0.09
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
91 7 -0.15
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
92 8 -0.15
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
93 9 -0.15
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
94
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
95 > <PUBCHEM_EFFECTIVE_ROTOR_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
96 3
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
97
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
98 > <PUBCHEM_PHARMACOPHORE_FEATURES>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
99 5
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
100 1 2 acceptor
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
101 1 3 acceptor
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
102 1 4 acceptor
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
103 3 2 3 11 anion
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
104 6 5 6 7 8 9 10 rings
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
105
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
106 > <PUBCHEM_HEAVY_ATOM_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
107 13
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
108
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
109 > <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
110 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
111
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
112 > <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
113 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
114
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
115 > <PUBCHEM_BOND_DEF_STEREO_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
116 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
117
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
118 > <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
119 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
120
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
121 > <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
122 0
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
123
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
124 > <PUBCHEM_COMPONENT_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
125 1
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
126
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
127 > <PUBCHEM_CACTVS_TAUTO_COUNT>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
128 1
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
129
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
130 > <PUBCHEM_CONFORMER_ID>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
131 000008C400000001
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
132
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
133 > <PUBCHEM_COORDINATE_TYPE>
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
134 2
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
135 5
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
136 10
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
137
0850f2dfba13 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/tools/text_processing/split_file_to_collection commit 872590086696cfbc248519507ecb9063926297ad"
bgruening
parents: 2
diff changeset
138 $$$$