rotamer_clash.cc File Reference

#include <devel/init.hh>
#include <basic/options/option.hh>
#include <basic/options/option_macros.hh>
#include <basic/options/keys/in.OptionKeys.gen.hh>
#include <basic/options/keys/score.OptionKeys.gen.hh>
#include <core/pose/Pose.hh>
#include <core/pose/annotated_sequence.hh>
#include <core/conformation/Residue.hh>
#include <core/chemical/ChemicalManager.hh>
#include <core/chemical/ResidueTypeSet.hh>
#include <core/scoring/ScoreFunction.hh>
#include <core/scoring/ScoreType.hh>
#include <core/scoring/ScoreFunctionFactory.hh>
#include <core/scoring/Energies.hh>
#include <core/scoring/EnergyMap.hh>
#include <core/pack/rotamer_set/RotamerSet.hh>
#include <core/pack/rotamer_set/RotamerSets.hh>
#include <core/pack/dunbrack/RotamerLibrary.hh>
#include <core/pack/dunbrack/DunbrackRotamer.hh>
#include <core/pack/dunbrack/RotamerLibraryScratchSpace.fwd.hh>
#include <core/pack/dunbrack/SingleResidueDunbrackLibrary.hh>
#include <utility/vector1.hh>
#include <utility/io/izstream.hh>
#include <iostream>
#include <fstream>

Classes
struct	myspace::InputData

Namespaces
	myspace

Functions
Real	myspace::periodic (Real ang)
Real	myspace::nonperiodic (Real ang)
utility::vector1< InputData >	myspace::read_input (std::string const filename)
Size	myspace::find_nearest_rot (utility::vector1< Real > chi, utility::vector1< pack::dunbrack::Real4 > rotchis)
pose::Pose	myspace::pose_from_scratch (InputData input)
Size	myspace::get_clash_type (pose::Pose const &pose,)
void	myspace::check_clash (pose::Pose &pose, chemical::ResidueTypeSetCAP rsd_set, pack::dunbrack::RotamerLibrary const &rotlib, InputData input)
int	main (int argc, char *argv[])

Function Documentation

main()

int main	(	int	argc,
		char *	argv[]
	)

References argv, myspace::check_clash(), utility::io::oc::cout, pyrosetta::create_score_function, create_a3b_hbs::i, basic::init(), gaussian-sampling::input, NEW_OPT, option, predPRE::pdbname, beta_nonlocal::pose, pyrosetta.distributed.io::pose_from_file, myspace::read_input(), and score::weights().