Mercurial > repos > bgruening > openbabel_spectrophore_search

view test-data/ob_filter_on_CID2244_2.smi @ 6:0b9ee280c439 draft

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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 3ba9268697beb4827bd9e8e639e70166f224cb8b
author bgruening
date Mon, 03 Sep 2018 16:41:49 -0400
parents 7133973beaf0
children
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O(c1c(cccc1)C(=O)O)C(=O)C	2244