core::pose::metrics::simple_calculators::SasaCalculator2 Class Reference

#include <SasaCalculator2.hh>

Inheritance diagram for core::pose::metrics::simple_calculators::SasaCalculator2:

Public Member Functions
	SasaCalculator2 ()
	SasaCalculator2 (core::Real probe_r)
core::pose::metrics::PoseMetricCalculatorOP	clone () const override
Public Member Functions inherited from core::pose::metrics::StructureDependentCalculator
	StructureDependentCalculator ()
void	notify_structure_change () override
void	get (std::string const &key, basic::MetricValueBase &val, Pose const &this_pose) override
std::string	get (std::string const &key, Pose const &this_pose) override
Public Member Functions inherited from core::pose::metrics::PoseMetricCalculator
	PoseMetricCalculator ()
virtual void	notify_energy_change ()

Protected Member Functions
void	lookup (std::string const &key, basic::MetricValueBase *valptr) const override
std::string	print (std::string const &key) const override
void	recompute (core::pose::Pose const &this_pose) override

Private Attributes
core::scoring::sasa::SasaCalcOP	sasa_calc_
core::Real	total_sasa_
core::Real	total_hsasa_
core::Real	total_rel_hsasa_
core::id::AtomID_Map< core::Real >	atom_sasa_
utility::vector1< core::Real >	residue_sasa_
utility::vector1< core::Real >	residue_hsasa_
utility::vector1< core::Real >	residue_rel_hsasa_
core::Real	total_sasa_sc_
core::Real	total_hsasa_sc_
utility::vector1< core::Real >	residue_sasa_sc_
utility::vector1< core::Real >	residue_hsasa_sc_

Constructor & Destructor Documentation

core::pose::metrics::simple_calculators::SasaCalculator2::SasaCalculator2

(

)

core::pose::metrics::simple_calculators::SasaCalculator2::SasaCalculator2

(

core::Real

probe_r

)

Member Function Documentation

core::pose::metrics::PoseMetricCalculatorOP core::pose::metrics::simple_calculators::SasaCalculator2::clone ( ) const

inlineoverridevirtual

Implements core::pose::metrics::PoseMetricCalculator.

void core::pose::metrics::simple_calculators::SasaCalculator2::lookup ( std::string const &  key, basic::MetricValueBase *  valptr  ) const

overrideprotectedvirtual

Implements core::pose::metrics::StructureDependentCalculator.

std::string core::pose::metrics::simple_calculators::SasaCalculator2::print ( std::string const &  key ) const

overrideprotectedvirtual

Implements core::pose::metrics::StructureDependentCalculator.

References core::id::to_string().

void core::pose::metrics::simple_calculators::SasaCalculator2::recompute ( core::pose::Pose const &  this_pose )

overrideprotectedvirtual

Implements core::pose::metrics::StructureDependentCalculator.

Member Data Documentation

core::id::AtomID_Map<core::Real > core::pose::metrics::simple_calculators::SasaCalculator2::atom_sasa_

private

utility::vector1< core::Real > core::pose::metrics::simple_calculators::SasaCalculator2::residue_hsasa_

private

utility::vector1< core::Real > core::pose::metrics::simple_calculators::SasaCalculator2::residue_hsasa_sc_

private

utility::vector1< core::Real > core::pose::metrics::simple_calculators::SasaCalculator2::residue_rel_hsasa_

private

utility::vector1< core::Real > core::pose::metrics::simple_calculators::SasaCalculator2::residue_sasa_

private

utility::vector1< core::Real > core::pose::metrics::simple_calculators::SasaCalculator2::residue_sasa_sc_

private

core::scoring::sasa::SasaCalcOP core::pose::metrics::simple_calculators::SasaCalculator2::sasa_calc_

private

core::Real core::pose::metrics::simple_calculators::SasaCalculator2::total_hsasa_

private

core::Real core::pose::metrics::simple_calculators::SasaCalculator2::total_hsasa_sc_

private

core::Real core::pose::metrics::simple_calculators::SasaCalculator2::total_rel_hsasa_

private

core::Real core::pose::metrics::simple_calculators::SasaCalculator2::total_sasa_

private

core::Real core::pose::metrics::simple_calculators::SasaCalculator2::total_sasa_sc_

private

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

• src/core/pose/metrics/simple_calculators/SasaCalculator2.hh
• src/core/pose/metrics/simple_calculators/SasaCalculator2.cc