Mercurial > repos > bgruening > ctb_frankenstein_ligand

annotate test-data/wrong_receptor.prm @ 2:7255688c77f3 draft default tip

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdock commit 944ea4bb8a9cd4244152a4a4fecd0485fabc2ad0"
author bgruening
date Tue, 28 Jul 2020 08:44:17 -0400
parents 7a4306d69801
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
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0
7a4306d69801 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdock commit 6037a8c8d53839daad1b183e1ae0329862ac2c2c"
bgruening
parents:
diff changeset
1 RBT_PARAMETER_FILE_V1.00
7a4306d69801 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdock commit 6037a8c8d53839daad1b183e1ae0329862ac2c2c"
bgruening
parents:
diff changeset
2 RECEPTOR_FILE a_terrible_mistake.mol2
7a4306d69801 "planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdock commit 6037a8c8d53839daad1b183e1ae0329862ac2c2c"
bgruening
parents:
diff changeset
3 RECEPTOR_FLEX 3.0