Mercurial > repos > bgruening > prepare_ligands_for_docking

view test-data/ob_convert_on_CID2244.inchi @ 6:5486f7a2b0cb draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 327c29cc43f56d7067ab9fa51323ea31951db98b"
author bgruening
date Tue, 10 Nov 2020 20:38:02 +0000
parents 06340f46ecb8
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InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12) 2244