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SapConstraintHelper.hh File Reference

Score term that applies the RotamerPSSMConstraint as an energy. More...

#include <core/pack/guidance_scoreterms/sap/SapConstraintHelper.fwd.hh>
#include <core/pack/guidance_scoreterms/sap/SapConstraintOptions.fwd.hh>
#include <core/pack/guidance_scoreterms/sap/SapDatabase.hh>
#include <core/id/AtomID_Map.hh>
#include <core/pack_basic/RotamerSetsBase.hh>
#include <core/pack/rotamer_set/RotamerSets.hh>
#include <core/scoring/methods/ContextIndependentTwoBodyEnergy.hh>
#include <core/scoring/methods/EnergyMethodCreator.hh>
#include <core/scoring/methods/EnergyMethodOptions.hh>
#include <core/conformation/Residue.hh>
#include <core/select/residue_selector/ResidueSelector.hh>
#include <core/scoring/ScoreFunction.hh>
#include <core/conformation/symmetry/SymmetryInfo.hh>
#include <utility/vector1.hh>
#include <utility/pointer/memory.hh>
#include <unordered_map>

Classes

struct  core::pack::guidance_scoreterms::sap::MyTemplatePointerHash1< Tval >
 
struct  core::pack::guidance_scoreterms::sap::RotamerRotamerHasher
 
class  core::pack::guidance_scoreterms::sap::SapConstraintHelper
 

Namespaces

 core
 A class for reading in the atom type properties.
 
 core::pack
 
 core::pack::guidance_scoreterms
 
 core::pack::guidance_scoreterms::sap
 

Macros

#define ATOM_WITHIN_5_ELEMS   40
 
#define ATOM_SASA_SCORE_ELEMS   46
 
#define BAD_AA_INDEX   65535
 
#define BAD_SEQPOS_INDEX   4294967295
 

Detailed Description

Score term that applies the RotamerPSSMConstraint as an energy.

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

Macro Definition Documentation

#define ATOM_SASA_SCORE_ELEMS   46
#define ATOM_WITHIN_5_ELEMS   40
#define BAD_AA_INDEX   65535
#define BAD_SEQPOS_INDEX   4294967295