LK_DomeEnergy.hh File Reference

lk_dome second shell water interactions More...

#include <core/scoring/lkball/LK_DomeEnergy.fwd.hh>
#include <core/scoring/lkball/LK_BallEnergy.hh>
#include <core/scoring/lkball/LK_DomeInfo.hh>
#include <core/scoring/methods/ContextDependentTwoBodyEnergy.hh>
#include <core/scoring/methods/EnergyMethodCreator.hh>
#include <core/scoring/methods/EnergyMethodOptions.hh>
#include <core/chemical/ResidueType.hh>
#include <core/scoring/etable/count_pair/CountPairFunction.hh>
#include <numeric/cubic_polynomial.hh>
#include <utility/vector1.hh>
#include <utility/pointer/memory.hh>

Classes
class	core::scoring::lkball::LK_DomeEnergy
struct	core::scoring::lkball::DerivativeFinder
struct	core::scoring::lkball::DerivativeFinderWadj

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

Functions
void	core::scoring::lkball::evaluate_lk_dome_energy_for_atom_ranges (LK_DomeEnergy const &lk_dome, conformation::Residue const &rsd1, LKD_ResidueInfo const &rsd1_info, conformation::Residue const &rsd2, LKD_ResidueInfo const &rsd2_info, ScoreFunction const &sfxn, etable::count_pair::CountPairFunction const &cpfxn, Size const res1_start_atom, Size const res1_end_atom, Size const res2_start_atom, Size const res2_end_atom, EnergyMap &emap)

Detailed Description

lk_dome second shell water interactions

Author

Brian Coventry (bcov@.nosp@m.uw.e.nosp@m.du)