Mercurial > repos > bgruening > openbabel_genprop
annotate test-data/3_mol.smi @ 6:ebe0654a8b85 draft
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 3ba9268697beb4827bd9e8e639e70166f224cb8b
author | bgruening |
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date | Mon, 03 Sep 2018 16:40:42 -0400 |
parents | df6d948e95ba |
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rev | line source |
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0
df6d948e95ba
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 01da22e4184a5a6f6a3dd4631a7b9c31d1b6d502
bgruening
parents:
diff
changeset
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1 CC(=O)OC1=CC=CC=C1C(=O)[O-] |
df6d948e95ba
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 01da22e4184a5a6f6a3dd4631a7b9c31d1b6d502
bgruening
parents:
diff
changeset
|
2 CC(=O)OC1=CC=CC=C1C(=O)[O-] |
df6d948e95ba
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 01da22e4184a5a6f6a3dd4631a7b9c31d1b6d502
bgruening
parents:
diff
changeset
|
3 C |