calculate_sasa.cc File Reference

#include <core/types.hh>
#include <core/id/AtomID.hh>
#include <core/conformation/Residue.hh>
#include <core/conformation/Conformation.hh>
#include <core/scoring/ScoreFunction.hh>
#include <core/scoring/ScoreFunctionFactory.hh>
#include <core/scoring/Energies.hh>
#include <core/scoring/rms_util.hh>
#include <core/scoring/rms_util.tmpl.hh>
#include <core/kinematics/MoveMap.hh>
#include <core/kinematics/FoldTree.hh>
#include <core/optimization/Minimizer.hh>
#include <core/optimization/MinimizerOptions.hh>
#include <protocols/minimization_packing/MinMover.hh>
#include <devel/init.hh>
#include <core/pose/Pose.hh>
#include <core/import_pose/import_pose.hh>
#include <basic/options/option.hh>
#include <basic/options/util.hh>
#include <basic/basic.hh>
#include <basic/database/open.hh>
#include <utility/vector1.hh>
#include <utility/string_util.hh>
#include <utility/excn/Exceptions.hh>
#include <numeric/xyzVector.io.hh>
#include <numeric/xyzMatrix.io.hh>
#include <fstream>
#include <iostream>
#include <string>
#include <algorithm>
#include <map>
#include <cstdlib>
#include <basic/options/keys/in.OptionKeys.gen.hh>

Functions
void	calculate_sasa ()
int	main (int argc, char *argv[])

Function Documentation

void calculate_sasa

(

)

References basic::options::OptionKeys::chemical::chemical, utility::io::oc::cout, pyrosetta::create_score_function, option, options, demo.D010_Pose_structure::pose, pyrosetta.distributed.io::pose_from_file, in::file::s(), basic::options::OptionKeys::AnchoredDesign::filters::sasa, basic::options::OptionKeys::frags::scoring::scoring, and basic::options::OptionKeys::optE::weights.

Referenced by main().

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

References calculate_sasa(), utility::io::oc::cerr, test.T009_Exceptions::e, devel::init(), and utility::excn::Exception::msg().