core::scoring::ResPairMinimizationData Class Reference

#include <MinimizationData.hh>

Inheritance diagram for core::scoring::ResPairMinimizationData:

Public Types
typedef basic::datacache::CacheableData	CacheableData
typedef basic::datacache::CacheableDataOP	CacheableDataOP
typedef basic::datacache::CacheableDataCOP	CacheableDataCOP

Public Member Functions
	ResPairMinimizationData ()
	~ResPairMinimizationData () override
	ResPairMinimizationData (ResPairMinimizationData const &)
ResPairMinimizationData &	operator= (ResPairMinimizationData const &)
void	set_data (min_pair_data index, CacheableDataOP)
CacheableDataOP	get_data (min_pair_data index)
CacheableDataCOP	get_data (min_pair_data index) const
CacheableData &	get_data_ref (min_pair_data index)
CacheableData const &	get_data_ref (min_pair_data index) const

Private Attributes
utility::vector1< CacheableDataOP >	data_cache_

Member Typedef Documentation

typedef basic::datacache::CacheableData core::scoring::ResPairMinimizationData::CacheableData

typedef basic::datacache::CacheableDataCOP core::scoring::ResPairMinimizationData::CacheableDataCOP

typedef basic::datacache::CacheableDataOP core::scoring::ResPairMinimizationData::CacheableDataOP

Constructor & Destructor Documentation

core::scoring::ResPairMinimizationData::ResPairMinimizationData

(

)

core::scoring::ResPairMinimizationData::~ResPairMinimizationData ( )

overridedefault

core::scoring::ResPairMinimizationData::ResPairMinimizationData

(

ResPairMinimizationData const &

other

)

References data_cache_, and core::scoring::n_min_pair_data.

Member Function Documentation

ResPairMinimizationData::CacheableDataOP core::scoring::ResPairMinimizationData::get_data

(

min_pair_data

index

)

References data_cache_.

Referenced by core::scoring::disulfides::FullatomDisulfideEnergy::eval_residue_pair_derivatives(), core::scoring::constraints::ConstraintsEnergy::eval_residue_pair_derivatives(), core::scoring::elec::RNA_FA_ElecEnergy::eval_residue_pair_derivatives(), core::scoring::hbonds::HBondEnergy::eval_residue_pair_derivatives(), core::scoring::elec::FA_ElecEnergy::eval_residue_pair_derivatives(), core::scoring::custom_pair_distance::FullatomCustomPairDistanceEnergy::eval_residue_pair_derivatives(), core::scoring::etable::BaseEtableEnergy< Derived >::eval_residue_pair_derivatives(), core::scoring::disulfides::FullatomDisulfideEnergy::residue_pair_energy_ext(), core::scoring::constraints::ConstraintsEnergy::residue_pair_energy_ext(), core::scoring::elec::RNA_FA_ElecEnergy::residue_pair_energy_ext(), core::scoring::hbonds::HBondEnergy::residue_pair_energy_ext(), core::scoring::elec::FA_ElecEnergy::residue_pair_energy_ext(), core::scoring::etable::BaseEtableEnergy< Derived >::residue_pair_energy_ext(), core::scoring::custom_pair_distance::FullatomCustomPairDistanceEnergy::residue_pair_energy_ext(), core::scoring::methods::retrieve_mp_pairdata(), core::scoring::methods::retrieve_nonconst_mp_pairdata(), core::scoring::methods::retrieve_nonconst_vdw_pairdata(), core::scoring::methods::retrieve_vdw_pairdata(), core::scoring::constraints::ConstraintsEnergy::setup_for_derivatives_for_residue_pair(), core::scoring::magnesium::MgEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::elec::RNA_FA_ElecEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::methods::LK_PolarNonPolarEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::hbonds::HBondEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::rna::StackElecEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::geometric_solvation::GeometricSolEnergyEvaluator::setup_for_minimizing_for_residue_pair(), core::scoring::etable::BaseEtableEnergy< Derived >::setup_for_minimizing_for_residue_pair(), core::scoring::elec::FA_ElecEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::custom_pair_distance::FullatomCustomPairDistanceEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::lkball::LK_BallEnergy::setup_for_minimizing_for_residue_pair(), and core::scoring::constraints::ConstraintsEnergy::setup_for_scoring_for_residue_pair().

ResPairMinimizationData::CacheableDataCOP core::scoring::ResPairMinimizationData::get_data

(

min_pair_data

index

)

const

References data_cache_.

CacheableData& core::scoring::ResPairMinimizationData::get_data_ref ( min_pair_data  index )

inline

References data_cache_.

Referenced by core::scoring::magnesium::MgEnergy::eval_residue_pair(), core::scoring::rna::StackElecEnergy::eval_residue_pair_derivatives(), core::scoring::geometric_solvation::GeometricSolEnergyEvaluator::eval_residue_pair_derivatives(), core::scoring::methods::LK_PolarNonPolarEnergy::eval_residue_pair_derivatives(), core::scoring::lkball::LK_BallEnergy::eval_residue_pair_derivatives(), core::scoring::elec::RNA_FA_ElecEnergy::eval_residue_pair_derivatives(), core::scoring::hbonds::HBondEnergy::eval_residue_pair_derivatives(), core::scoring::elec::FA_ElecEnergy::eval_residue_pair_derivatives(), core::scoring::custom_pair_distance::FullatomCustomPairDistanceEnergy::eval_residue_pair_derivatives(), core::scoring::etable::BaseEtableEnergy< Derived >::eval_residue_pair_derivatives(), core::scoring::methods::LK_PolarNonPolarEnergy::residue_pair_energy_ext(), core::scoring::elec::RNA_FA_ElecEnergy::residue_pair_energy_ext(), core::scoring::hbonds::HBondEnergy::residue_pair_energy_ext(), core::scoring::geometric_solvation::GeometricSolEnergyEvaluator::residue_pair_energy_ext(), core::scoring::rna::StackElecEnergy::residue_pair_energy_ext(), core::scoring::elec::FA_ElecEnergy::residue_pair_energy_ext(), core::scoring::etable::BaseEtableEnergy< Derived >::residue_pair_energy_ext(), core::scoring::custom_pair_distance::FullatomCustomPairDistanceEnergy::residue_pair_energy_ext(), core::scoring::methods::retrieve_mp_pairdata(), and core::scoring::methods::retrieve_vdw_pairdata().

CacheableData const& core::scoring::ResPairMinimizationData::get_data_ref ( min_pair_data  index ) const

inline

References data_cache_.

ResPairMinimizationData & core::scoring::ResPairMinimizationData::operator=

(

ResPairMinimizationData const &

rhs

)

References data_cache_, and core::scoring::n_min_pair_data.

void core::scoring::ResPairMinimizationData::set_data	(	min_pair_data	index,
		CacheableDataOP	data
	)

References data_cache_.

Referenced by core::scoring::methods::retrieve_nonconst_mp_pairdata(), core::scoring::methods::retrieve_nonconst_vdw_pairdata(), core::scoring::magnesium::MgEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::disulfides::FullatomDisulfideEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::methods::LK_PolarNonPolarEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::elec::RNA_FA_ElecEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::hbonds::HBondEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::rna::StackElecEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::geometric_solvation::GeometricSolEnergyEvaluator::setup_for_minimizing_for_residue_pair(), core::scoring::etable::BaseEtableEnergy< Derived >::setup_for_minimizing_for_residue_pair(), core::scoring::elec::FA_ElecEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::custom_pair_distance::FullatomCustomPairDistanceEnergy::setup_for_minimizing_for_residue_pair(), core::scoring::constraints::ConstraintSet::setup_for_minimizing_for_residue_pair(), and core::scoring::lkball::LK_BallEnergy::setup_for_minimizing_for_residue_pair().

Member Data Documentation

utility::vector1< CacheableDataOP > core::scoring::ResPairMinimizationData::data_cache_

private

Referenced by get_data(), get_data_ref(), operator=(), ResPairMinimizationData(), and set_data().

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

• src/core/scoring/MinimizationData.hh
• src/core/scoring/MinimizationData.cc