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OccludedHbondSolEnergy.cc File Reference

Solvation model based on penalizing potential for Hbonding to solvent. More...

#include <core/scoring/geometric_solvation/OccludedHbondSolEnergy.hh>
#include <core/scoring/geometric_solvation/OccludedHbondSolEnergyCreator.hh>
#include <core/chemical/AtomType.hh>
#include <core/conformation/Residue.hh>
#include <core/scoring/DerivVectorPair.hh>
#include <core/scoring/EnergyMap.hh>
#include <core/scoring/ScoringManager.hh>
#include <core/scoring/geometric_solvation/DatabaseOccSolEne.hh>
#include <core/scoring/methods/EnergyMethodOptions.hh>
#include <core/pose/Pose.hh>
#include <basic/Tracer.hh>
#include <numeric/trig.functions.hh>
#include <numeric/deriv/distance_deriv.hh>
#include <numeric/deriv/angle_deriv.hh>
#include <ObjexxFCL/format.hh>
#include <utility/vector1.hh>

Namespaces

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

Constant Groups

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

Functions

static basic::Tracer tr ("core.scoring.geometric_solvation.OccludedHbondSolEnergy")
 

Variables

Vector core::scoring::geometric_solvation::dummy_deriv_vector_
 
core::Real const core::scoring::geometric_solvation::MIN_OCC_ENERGY = { 0.01 }
 

Detailed Description

Solvation model based on penalizing potential for Hbonding to solvent.

Author
John Karanicolas

Function Documentation

static basic::Tracer tr ( "core.scoring.geometric_solvation.OccludedHbondSolEnergy"  )
static