zzz.scripts
Folders and files
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# A List and Description of all the scripts in this directory add_TER.py break_into_fp.py break_into_mol.py calc_rmsd_mol2.py chunk_size_computer.pl clean_mol2.py concatenate_mol2_new_headers_descriptor.pl concatenate_mol2_new_headers.pl csv_of_picked_compounds.py db_extractmoleculename.svl db_sm_Extract.svl dms dock_csv.py dock_csv_updated_2_descriptor.norank.py dock_csv_updated_descriptor.norank.py dock_csv_updated_descriptor.py dock_csv_updated.py fix_long_bonds.pl fix_nonstandard_res.pl foramber.sed keep_close_atoms.pl keep_close_spheres.pl lig_unique_name.pl make_database.py make_database_unique.py mol2.py mol2.pyc ph4clust_jj.svl plot_footprint.py plot_footprint_updated.py pubchem_ping_denovo.py radii remove_duplicate_mol2s.pl remove_duplicate_mol2s_update.pl remove_hydrogens.pl renumber_residues_in_mol2_for_moe.py replace_denovo_names.py sort_and_save.py sort_and_save_updated_descriptor.py sort_and_save_updated.py split_on_tanimoto_new.py updated_similarity_mols_in_zinc15.py write_sph2.py write_sph.py