Pull Request №59 RosettaCommons/rosetta/main ← RosettaCommons/rosetta/updated_ligand_discovery_search_code_ag_may_2024
Merge: 74f819c4dd58142810833fb8e63211f2974ee342←b424024a00007f5ad6519a8c8b3d5a3ba8a6d996
Updated Ligand Motifs Code
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Merge commit message:
substantial update to integrate the usage of the proteingrid into
liganddiscoverysearch. Also added getting functions for getting the
fullness ratios from the protein_grid. Also cleaned some options out of
options_rosetta that are now depreceted