Mercurial > repos > bgruening > openbabel_remove_protonation_state

annotate test-data/CID_2244.inchi @ 15:2956017a9244 draft default tip

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planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openbabel commit d9c51279c061a1da948a2582d5b502ca7573adbf
author bgruening
date Thu, 15 Aug 2024 10:53:50 +0000
parents 6f511affb852
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
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6f511affb852 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)