LK_BallInfo.cc File Reference

LK Solvation using hemisphere culling class declaration. More...

#include <core/scoring/methods/LK_BallInfo.hh>
#include <core/pose/Pose.hh>
#include <core/conformation/Residue.hh>
#include <core/conformation/ResidueFactory.hh>
#include <basic/options/util.hh>
#include <basic/database/open.hh>
#include <core/io/pdb/pose_io.hh>
#include <fstream>
#include <ObjexxFCL/format.hh>
#include <ObjexxFCL/string.functions.hh>
#include <core/chemical/types.hh>
#include <core/chemical/AtomType.hh>
#include <core/chemical/AtomTypeSet.hh>
#include <core/kinematics/Stub.hh>
#include <basic/Tracer.hh>
#include <basic/options/keys/dna.OptionKeys.gen.hh>
#include <numeric/conversions.hh>
#include <numeric/xyz.functions.hh>
#include <utility/io/izstream.hh>
#include <utility/tools/make_vector1.hh>
#include <sstream>

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

Functions
Vector	core::scoring::methods::build_optimal_water_O_on_donor (Vector const &hxyz, Vector const &dxyz)
utility::vector1< Vector >	core::scoring::methods::build_optimal_water_Os_on_acceptor (Size const acc_atm, conformation::Residue const &acc_rsd, Vector const &a_xyz, Vector b1_xyz, Vector b2_xyz, chemical::Hybridization const &hybrid)
void	core::scoring::methods::setup_water_builders_for_residue_type (ResidueType const &rsd_type, bool const sidechain_only, utility::vector1< WaterBuilders > &rsd_water_builders)

Variables
static basic::Tracer	core::scoring::methods::TR ("core.scoring.methods.LK_BallInfo")
static Real const	core::scoring::methods::optimal_water_distance (2.65)

Detailed Description

LK Solvation using hemisphere culling class declaration.

Author

David Baker

Andrew Leaver-Fay