Mercurial > repos > bgruening > ctb_frankenstein_ligand
diff test-data/select_points_output_v3000.sdf @ 1:8e214e52e461 draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdock commit dff183f4eb2d3df42917ec4fed0fbdb2ea11e19a"
author | bgruening |
---|---|
date | Thu, 21 May 2020 10:55:41 -0400 |
parents | 7a4306d69801 |
children |
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--- a/test-data/select_points_output_v3000.sdf Mon May 04 07:41:13 2020 -0400 +++ b/test-data/select_points_output_v3000.sdf Thu May 21 10:55:41 2020 -0400 @@ -1,6 +1,6 @@ -Frankenstein_ligand -Galaxy select_points_sdf tool - +Frankenstein ligand +00000000000000000000 3D +Created in Galaxy 43 0 0 0 0 0 0 0 0 0999 V2000 9.8790 -5.4960 26.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 -5.0190 26.2290 C 0 0 0 0 0 0 0 0 0 0 0 0