core::energy_methods::FAElecContextData Class Reference

#include <FA_GrpElecEnergy.hh>

Inheritance diagram for core::energy_methods::FAElecContextData:

Public Member Functions
	FAElecContextData ()
	~FAElecContextData () override
void	initialize (Size const nres)
basic::datacache::CacheableDataOP	clone () const override
Real &	n (core::Size i)
Real	get_n (core::Size i) const
Vector &	dw_dr (core::Size i)
Vector	get_dw_dr (core::Size i) const
utility::vector1< Size > &	boundary_neighs (core::Size i)
utility::vector1< Size >	get_boundary_neighs (core::Size i) const

Private Attributes
utility::vector1< Real >	n_
utility::vector1< Vector >	dw_dr_
utility::vector1 < utility::vector1< Size > >	boundary_neighs_

Constructor & Destructor Documentation

core::energy_methods::FAElecContextData::FAElecContextData ( )

default

core::energy_methods::FAElecContextData::~FAElecContextData ( )

overridedefault

Member Function Documentation

utility::vector1< Size >& core::energy_methods::FAElecContextData::boundary_neighs ( core::Size  i )

inline

References boundary_neighs_.

basic::datacache::CacheableDataOP core::energy_methods::FAElecContextData::clone ( ) const

inlineoverride

Vector& core::energy_methods::FAElecContextData::dw_dr ( core::Size  i )

inline

References dw_dr_.

utility::vector1< Size > core::energy_methods::FAElecContextData::get_boundary_neighs ( core::Size  i ) const

inline

Vector core::energy_methods::FAElecContextData::get_dw_dr ( core::Size  i ) const

inline

References dw_dr_.

Real core::energy_methods::FAElecContextData::get_n ( core::Size  i ) const

inline

References n_.

Referenced by core::energy_methods::FA_GrpElecEnergy::residue_pair_energy().

void core::energy_methods::FAElecContextData::initialize

(

Size const

nres

)

Real& core::energy_methods::FAElecContextData::n ( core::Size  i )

inline

References n_.

Member Data Documentation

utility::vector1< utility::vector1< Size > > core::energy_methods::FAElecContextData::boundary_neighs_

private

Referenced by boundary_neighs().

utility::vector1< Vector > core::energy_methods::FAElecContextData::dw_dr_

private

Referenced by dw_dr(), and get_dw_dr().

utility::vector1< Real > core::energy_methods::FAElecContextData::n_

private

Referenced by get_n(), and n().

---

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

• src/core/energy_methods/FA_GrpElecEnergy.hh
• src/core/energy_methods/FA_GrpElecEnergy.cc