Mercurial > repos > bgruening > rxdock_rbdock

comparison test-data/ligand.sdf @ 0:35ee2e002bb0 draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rxdock commit bb19570293b920983b6856b30b42203a09543bc5"
author bgruening
date Sat, 04 Apr 2020 15:00:22 -0400
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comparison
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-1:000000000000 0:35ee2e002bb0
1 1S3V
2 OpenBabel07031809403D
3
4 54 56 0 0 1 0 0 0 0 0999 V2000
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115 M END
116 $$$$