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core::scoring::SASAPotential Class Reference

#include <SASAPotential.hh>

Inheritance diagram for core::scoring::SASAPotential:
Inheritance graph
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Public Types

typedef core::conformation::Residue Residue
 

Public Member Functions

 SASAPotential ()
 ctor More...
 
void setup_for_scoring (pose::Pose &pose) const
 
Real get_res_res_sasa (Residue const &rsd1, Residue const &rsd2) const
 
void eval_residue_pair_derivatives (conformation::Residue const &rsd1, conformation::Residue const &rsd2, pose::Pose const &pose, Real const &factor, utility::vector1< DerivVectorPair > &r1_atom_derivs, utility::vector1< DerivVectorPair > &r2_atom_derivs) const
 
Sizevertex_count ()
 

Private Attributes

Size vertex_count_
 
power_diagram::PowerDiagramOP pd_
 

Member Typedef Documentation

Constructor & Destructor Documentation

core::scoring::SASAPotential::SASAPotential ( )
inline

ctor

References pd_.

Member Function Documentation

void core::scoring::SASAPotential::eval_residue_pair_derivatives ( conformation::Residue const &  rsd1,
conformation::Residue const &  rsd2,
pose::Pose const &  pose,
Real const &  factor,
utility::vector1< DerivVectorPair > &  r1_atom_derivs,
utility::vector1< DerivVectorPair > &  r2_atom_derivs 
) const
Real core::scoring::SASAPotential::get_res_res_sasa ( Residue const &  rsd1,
Residue const &  rsd2 
) const
void core::scoring::SASAPotential::setup_for_scoring ( pose::Pose pose) const
Size& core::scoring::SASAPotential::vertex_count ( )
inline

References vertex_count_.

Member Data Documentation

power_diagram::PowerDiagramOP core::scoring::SASAPotential::pd_
private

Referenced by SASAPotential().

Size core::scoring::SASAPotential::vertex_count_
private

Referenced by vertex_count().


The documentation for this class was generated from the following files: