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Public Member Functions | Private Attributes | List of all members
core::scoring::methods::dfire::DFIRE_Potential Class Reference

#include <DFIRE_Potential.hh>

Inheritance diagram for core::scoring::methods::dfire::DFIRE_Potential:
Inheritance graph
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Public Member Functions

 DFIRE_Potential ()
 
 ~DFIRE_Potential () override
 
core::Real eval_dfire_pair_energy (core::conformation::Residue const &rsd1, core::conformation::Residue const &rsd2) const
 
bool is_loaded () const
 
void read_potential (std::string const &fn)
 

Private Attributes

bool potential_is_loaded_
 
boost::unordered_map< std::string, core::Sizeatom_res_idx_
 
utility::vector1< utility::vector1< core::Real > > potential_
 

Constructor & Destructor Documentation

◆ DFIRE_Potential()

core::scoring::methods::dfire::DFIRE_Potential::DFIRE_Potential ( )

◆ ~DFIRE_Potential()

core::scoring::methods::dfire::DFIRE_Potential::~DFIRE_Potential ( )
overridedefault

Member Function Documentation

◆ eval_dfire_pair_energy()

core::Real core::scoring::methods::dfire::DFIRE_Potential::eval_dfire_pair_energy ( core::conformation::Residue const &  rsd1,
core::conformation::Residue const &  rsd2 
) const

◆ is_loaded()

bool core::scoring::methods::dfire::DFIRE_Potential::is_loaded ( ) const

◆ read_potential()

void core::scoring::methods::dfire::DFIRE_Potential::read_potential ( std::string const &  fn)

Member Data Documentation

◆ atom_res_idx_

boost::unordered_map< std::string, core::Size > core::scoring::methods::dfire::DFIRE_Potential::atom_res_idx_
private

◆ potential_

utility::vector1< utility::vector1< core::Real > > core::scoring::methods::dfire::DFIRE_Potential::potential_
private

◆ potential_is_loaded_

bool core::scoring::methods::dfire::DFIRE_Potential::potential_is_loaded_
private

Referenced by is_loaded(), and read_potential().


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