Pull Request №59 RosettaCommons/rosetta/main ← RosettaCommons/rosetta/updated_ligand_discovery_search_code_ag_may_2024
Merge: 74f819c4dd58142810833fb8e63211f2974ee342←5cc64a5558f31e8bd3c605c36aa5752e575c9771
Updated Ligand Motifs Code
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Merge commit message:
adding substantial progress on writing the functions for the space fill
and clash check analyses, along with setting up functionality for the
output of matrices. Also adjusted the initialization of member
variables to be performed in an initialization function that is called
at the start of constructors (besides the copy constructor). Also
preparing a new options space for protein_grid, and preparing to move
the options for defining how to print the matrix to pdb in this new
space