Mercurial > repos > bgruening > openbabel_spectrophore_search
annotate test-data/2_mol.dat @ 14:330514267c57 draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 327c29cc43f56d7067ab9fa51323ea31951db98b"
author | bgruening |
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date | Tue, 10 Nov 2020 20:39:26 +0000 |
parents | f93f3e01abe8 |
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rev | line source |
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f93f3e01abe8
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit ed9b6859de648aa5f7cde483732f5df20aaff90e
bgruening
parents:
diff
changeset
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1 CC(=O)OC1=CC=CC=C1C(=O)[O-] |
f93f3e01abe8
planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit ed9b6859de648aa5f7cde483732f5df20aaff90e
bgruening
parents:
diff
changeset
|
2 CC(=O)OC1=CC=CC=C1C(=O)[O-] |