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Rosetta
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#include <core/types.hh>#include <core/chemical/AtomTypeSet.hh>#include <core/chemical/MMAtomTypeSet.hh>#include <core/id/AtomID.hh>#include <core/chemical/AA.hh>#include <core/conformation/Residue.hh>#include <core/chemical/ResidueTypeSet.hh>#include <core/chemical/ResidueTypeSelector.hh>#include <core/chemical/ChemicalManager.hh>#include <core/conformation/ResidueFactory.hh>#include <core/chemical/residue_io.hh>#include <core/chemical/VariantType.hh>#include <devel/init.hh>#include <core/pose/Pose.hh>#include <core/pose/PDBInfo.hh>#include <core/scoring/etable/Etable.hh>#include <core/scoring/ScoringManager.hh>#include <core/scoring/ScoreFunction.hh>#include <core/scoring/ScoreType.hh>#include <core/scoring/ScoreFunctionFactory.hh>#include <core/scoring/Ramachandran.hh>#include <core/pack/dunbrack/RotamerLibrary.hh>#include <core/scoring/hbonds/HBondSet.hh>#include <core/scoring/hbonds/hbonds.hh>#include <core/scoring/etable/count_pair/CountPairFunction.hh>#include <core/scoring/LREnergyContainer.hh>#include <core/scoring/methods/LongRangeTwoBodyEnergy.hh>#include <core/scoring/TenANeighborGraph.hh>#include <core/pack/rotamer_trials.hh>#include <core/pack/pack_rotamers.hh>#include <core/pack/task/PackerTask.hh>#include <core/pack/task/TaskFactory.hh>#include <core/pack/task/operation/TaskOperation.hh>#include <core/pack/task/operation/TaskOperations.hh>#include <core/pack/rotamer_set/RotamerSet.hh>#include <core/pack/rotamer_set/RotamerSetFactory.hh>#include <core/pack/packer_neighbors.hh>#include <utility/graph/Graph.hh>#include <core/kinematics/FoldTree.hh>#include <core/kinematics/MoveMap.hh>#include <core/id/AtomID_Map.hh>#include <core/io/pdb/pdb_writer.hh>#include <core/mm/MMTorsionLibrary.hh>#include <core/mm/MMTorsionLibrary.fwd.hh>#include <core/optimization/types.hh>#include <core/optimization/Multifunc.hh>#include <core/optimization/AtomTreeMinimizer.hh>#include <core/optimization/Minimizer.hh>#include <core/optimization/MinimizerOptions.hh>#include <basic/options/util.hh>#include <basic/basic.hh>#include <basic/database/open.hh>#include <utility/vector1.hh>#include <utility/excn/Exceptions.hh>#include <utility/pointer/owning_ptr.hh>#include <utility/VirtualBase.hh>#include <numeric/xyzVector.hh>#include <numeric/random/random.hh>#include <ObjexxFCL/string.functions.hh>#include <protocols/dna/util.hh>#include <protocols/loops/Loops.hh>#include <protocols/motifs/Motif.hh>#include <protocols/motifs/MotifLibrary.hh>#include <protocols/motifs/IRCollection.hh>#include <fstream>#include <iostream>#include <string>#include <algorithm>#include <core/import_pose/import_pose.hh>Functions | |
| void | place_waters_and_minimize (Pose &pose) |
| void | build_asn_motifs () |
| int | main (int argc, char *argv[]) |
| void build_asn_motifs | ( | ) |
References pyrosetta::create_score_function, kic_runner::pdb, beta_nonlocal::pose, pyrosetta.distributed.io::pose_from_file, beta_nonlocal::score_fxn, and weights().
Referenced by main().
| int main | ( | int | argc, |
| char * | argv[] | ||
| ) |
References argv, build_asn_motifs(), test.T009_Exceptions::e, and basic::init().
| void place_waters_and_minimize | ( | Pose & | pose | ) |