core::scoring::GenBondedExclInfo Class Reference

#include <GenericBondedPotential.hh>

Inheritance diagram for core::scoring::GenBondedExclInfo:

Public Member Functions
	GenBondedExclInfo (bool const score_full, bool const score_hybrid)
basic::datacache::CacheableDataOP	clone () const override
void	add_residue_exclude_torsions (chemical::ResidueType const &rsd_type)
ResidueExclParamsCOP	get_residue_data (core::chemical::ResidueType const &rsd_type) const
ResidueExclParamsCOP	get_residue_pair_data (core::Size seqpos1, core::Size seqpos2) const

Private Attributes
bool	score_full_
bool	score_hybrid_
std::unordered_map < std::string, ResidueExclParamsOP >	perres_excls_
std::unordered_map< uint64_t, ResidueExclParamsOP >	respair_excls_

Constructor & Destructor Documentation

core::scoring::GenBondedExclInfo::GenBondedExclInfo	(	bool const	score_full,
		bool const	score_hybrid
	)

Referenced by clone().

Member Function Documentation

void core::scoring::GenBondedExclInfo::add_residue_exclude_torsions

(

chemical::ResidueType const &

rsd_type

)

References core::chemical::ResidueType::get_self_ptr(), core::chemical::ResidueTypeBase::name(), perres_excls_, score_full_, score_hybrid_, and core::scoring::TR().

basic::datacache::CacheableDataOP core::scoring::GenBondedExclInfo::clone ( ) const

inlineoverride

References GenBondedExclInfo().

ResidueExclParamsCOP core::scoring::GenBondedExclInfo::get_residue_data

(

core::chemical::ResidueType const &

rsd_type

)

const

References core::chemical::ResidueType::get_self_ptr(), core::chemical::ResidueTypeBase::name(), perres_excls_, score_full_, score_hybrid_, and core::scoring::TR().

ResidueExclParamsCOP core::scoring::GenBondedExclInfo::get_residue_pair_data	(	core::Size	seqpos1,
		core::Size	seqpos2
	)		const

References core::scoring::get_parameter_hash(), and respair_excls_.

Member Data Documentation

std::unordered_map< std::string, ResidueExclParamsOP > core::scoring::GenBondedExclInfo::perres_excls_

private

Referenced by add_residue_exclude_torsions(), and get_residue_data().

std::unordered_map< uint64_t, ResidueExclParamsOP > core::scoring::GenBondedExclInfo::respair_excls_

private

Referenced by get_residue_pair_data().

bool core::scoring::GenBondedExclInfo::score_full_

private

Referenced by add_residue_exclude_torsions(), and get_residue_data().

bool core::scoring::GenBondedExclInfo::score_hybrid_

private

Referenced by add_residue_exclude_torsions(), and get_residue_data().

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

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