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LK_BallEnergy.hh File Reference

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

#include <core/scoring/methods/LK_BallEnergy.fwd.hh>
#include <core/scoring/methods/LK_BallInfo.hh>
#include <core/scoring/methods/GenBornEnergy.hh>
#include <core/scoring/GenBornPotential.hh>
#include <core/conformation/Atom.fwd.hh>
#include <core/conformation/RotamerSetBase.fwd.hh>
#include <core/scoring/methods/ContextIndependentTwoBodyEnergy.hh>
#include <core/scoring/methods/EnergyMethodOptions.fwd.hh>
#include <core/scoring/etable/Etable.fwd.hh>
#include <core/scoring/ScoreFunction.fwd.hh>
#include <core/scoring/hbonds/types.hh>
#include <core/pose/Pose.fwd.hh>
#include <ObjexxFCL/FArray3D.hh>
#include <utility/vector1.hh>

Classes

class  core::scoring::methods::LK_BallEnergy
 

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

void core::scoring::methods::apply_lk_ball_fraction_weight_for_hbonds (Size const hatm, conformation::Residue const &don_rsd, Size const aatm, conformation::Residue const &acc_rsd, Vector const &hatm_xyz, Vector const &datm_xyz, Real &unweighted_energy, bool const evaluate_derivative, hbonds::HBondDerivs &hbderivs, Real &don_lk_fraction, Real &acc_lk_fraction)
 this is a helper function for hbonds More...
 

Detailed Description

LK Solvation using hemisphere culling class declaration.

Author
David Baker
Andrew Leaver-Fay