Mercurial > repos > bgruening > openbabel_spectrophore_search

view test-data/CID_2244_addh.can @ 13:9ce9f996b941 draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 1fe240ef0064a1a4a66d9be1ccace53824280b75"
author bgruening
date Mon, 19 Oct 2020 14:41:00 +0000
parents 7133973beaf0
children
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CC(=O)Oc1ccccc1C(=O)[O-]	2244