Mercurial > repos > bgruening > openbabel_spectrophore_search

annotate test-data/CID_2244.inchi @ 10:3d91d24e89c5 draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 6c84abdd07f292048bf2194073e2e938e94158c4"
author bgruening
date Wed, 25 Mar 2020 16:43:26 -0400
parents 7133973beaf0
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
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7133973beaf0 planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit 01da22e4184a5a6f6a3dd4631a7b9c31d1b6d502
bgruening
parents:
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1 InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)