Rosetta 3.5
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LK_BallInfo.cc File Reference
#include <core/scoring/methods/LK_BallInfo.hh>
#include <core/pose/Pose.hh>
#include <core/conformation/Residue.hh>
#include <core/conformation/ResidueFactory.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/kinematics/Stub.hh>
#include <basic/Tracer.hh>
#include <numeric/conversions.hh>
#include <numeric/xyz.functions.hh>

Namespaces

 core
 A class for defining atom parameters, known as atom_types.
 
 core::scoring
 
 core::scoring::methods
 

Constant Groups

 core
 A class for defining atom parameters, known as atom_types.
 
 core::scoring
 
 core::scoring::methods
 

Functions

static basic::Tracer core::scoring::methods::TR ("core.scoring.methods.LK_BallInfo")
 
static Real const core::scoring::methods::optimal_water_distance (2.65)
 
bool core::scoring::methods::residue_type_has_waters (ResidueType const &rsd_type)
 note that this number is re-defined in hbonds.cc !! More...
 
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)