Rosetta
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Files | |
file | deepMove.cc |
This is to illustrate packing residues in a PDB @detail Run this script with the following arguments: 1) in::file::s <list of one PDB with at least 2 residues to pack> 2) in::path::database ) in::file::extra_res_fa <list of extra params files, one per residue type> | |
file | ligand_design.cc |
file | pack.cc |
This is to illustrate packing residues in a PDB @detail Run this script with the following arguments: 1) in::file::s <list of one PDB with at least 2 residues to pack> 2) in::path::database ) in::file::extra_res_fa <list of extra params files, one per residue type> | |
file | protonatePack.cc |
This is to illustrate reading in a ligand with multiple residues and then reassembling the ligand (using Rosetta). @detail Run this script with the following arguments: 1) in::file::s ) in::path::database <root director of minirosetta database> 3) in::file::extra_res_fa <list of extra params files, one per residue type> | |
file | randomMove.cc |
This is to illustrate packing residues in a PDB @detail Run this script with the following arguments: 1) in::file::s <list of one PDB with at least 2 residues to pack> 2) in::path::database ) in::file::extra_res_fa <list of extra params files, one per residue type> | |
file | readAndWrite.cc |
This is to illustrate reading a PDB @detail Run this script with the following arguments: 1) in::file::s ) in::file::extra_res_fa <list of extra params files, one per residue type> | |
file | rmsd_calculator.cc |
file | simpleScore.cc |
This is to illustrate scoring a PDB @detail Run this script with the following arguments: 1) in::file::s ) in::file::extra_res_fa <list of extra params files, one per residue type> | |
file | undirected_graph.cc |