ChemicalShiftAnisotropy.cc File Reference

Uses NMR CSA for scoring (Bertram R et al J of Magn Reson 147, 9-16) More...

#include <core/scoring/ChemicalShiftAnisotropy.hh>
#include <core/conformation/Residue.hh>
#include <basic/options/option.hh>
#include <basic/datacache/BasicDataCache.hh>
#include <core/pose/datacache/CacheableDataType.hh>
#include <core/pose/Pose.hh>
#include <basic/Tracer.hh>
#include <ObjexxFCL/format.hh>
#include <fstream>
#include <string>
#include <utility/excn/Exceptions.hh>
#include <utility/io/izstream.hh>
#include <basic/options/keys/in.OptionKeys.gen.hh>
#include <basic/options/keys/csa.OptionKeys.gen.hh>
#include <numeric/xyz.functions.hh>
#include <numeric/xyzVector.hh>
#include <numeric/xyzMatrix.hh>
#include <core/scoring/MembranePotential.hh>

Namespaces
	core
	A class for reading in the atom type properties.
	core::scoring

Functions
static basic::Tracer	tr ("core.scoring.ChemicalShiftAnisotropy")
	Utility headers. More...
void	core::scoring::store_CSA_in_pose (ChemicalShiftAnisotropyOP csa_info, core::pose::Pose &pose)
ChemicalShiftAnisotropyCOP	core::scoring::retrieve_CSA_from_pose (core::pose::Pose const &pose)
ChemicalShiftAnisotropyOP	core::scoring::retrieve_CSA_from_pose (core::pose::Pose &pose)
std::ostream &	core::scoring::operator<< (std::ostream &out, CSA const &csa)
std::ostream &	core::scoring::operator<< (std::ostream &out, ChemicalShiftAnisotropy const &csa)

Detailed Description

Uses NMR CSA for scoring (Bertram R et al J of Magn Reson 147, 9-16)

Author

Lei Shi

Function Documentation

tr()

static basic::Tracer tr ( "core.scoring.ChemicalShiftAnisotropy"  )

static

Utility headers.