Mercurial > repos > bgruening > prepare_ligands_for_docking

view test-data/ob_remove_protonation_state.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 a5f4b80e6769
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InChI=1S/C7H5O3.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4H,(H,9,10);