protocols::membrane::scoring::MEnvAtomParams Class Reference

A container for storing memrbane environemnt parameters and derivatives. More...

#include <MEnvAtomParams.hh>

Inheritance diagram for protocols::membrane::scoring::MEnvAtomParams:

Public Member Functions
	MEnvAtomParams ()
	MEnvAtomParams (std::string const &atom_type_name, core::Real const dGfreeW, core::Real const dGfreeB, core::Real const hyd, core::Real const hyd_deriv, core::Vector const &memb_coord)
	MEnvAtomParams (MEnvAtomParams const &src)
	~MEnvAtomParams () override
MEnvAtomParamsOP	clone () const
void	set_hydration (core::Real hyd)
std::string	atom_type_name () const
core::Real	dGfreeW () const
core::Real	dGfreeB () const
core::Real	hydration () const
core::Real	hydration_deriv () const
core::Vector	memb_coord () const

Private Attributes
std::string	atom_type_name_
core::Real	dGfreeW_
core::Real	dGfreeB_
core::Real	hyd_
core::Real	hyd_deriv_
numeric::xyzVector< core::Real >	memb_coord_

Detailed Description

A container for storing memrbane environemnt parameters and derivatives.

Constructor & Destructor Documentation

protocols::membrane::scoring::MEnvAtomParams::MEnvAtomParams

(

)

Referenced by clone().

protocols::membrane::scoring::MEnvAtomParams::MEnvAtomParams	(	std::string const &	atom_type_name,
		core::Real const	dGfreeW,
		core::Real const	dGfreeB,
		core::Real const	hyd,
		core::Real const	hyd_deriv,
		core::Vector const &	memb_coord
	)

protocols::membrane::scoring::MEnvAtomParams::MEnvAtomParams

(

MEnvAtomParams const &

src

)

protocols::membrane::scoring::MEnvAtomParams::~MEnvAtomParams ( )

override

Member Function Documentation

std::string protocols::membrane::scoring::MEnvAtomParams::atom_type_name ( ) const

inline

References atom_type_name_.

MEnvAtomParamsOP protocols::membrane::scoring::MEnvAtomParams::clone

(

)

const

References MEnvAtomParams().

core::Real protocols::membrane::scoring::MEnvAtomParams::dGfreeB ( ) const

inline

References dGfreeB_.

Referenced by protocols::membrane::scoring::FaWaterToBilayerEnergy::eval_fa_wtbe().

core::Real protocols::membrane::scoring::MEnvAtomParams::dGfreeW ( ) const

inline

References dGfreeW_.

Referenced by protocols::membrane::scoring::FaWaterToBilayerEnergy::eval_fa_wtbe().

core::Real protocols::membrane::scoring::MEnvAtomParams::hydration ( ) const

inline

References hyd_.

Referenced by protocols::membrane::scoring::FaWaterToBilayerEnergy::eval_fa_wtbe().

core::Real protocols::membrane::scoring::MEnvAtomParams::hydration_deriv ( ) const

inline

References hyd_deriv_.

core::Vector protocols::membrane::scoring::MEnvAtomParams::memb_coord ( ) const

inline

References memb_coord_.

void protocols::membrane::scoring::MEnvAtomParams::set_hydration ( core::Real  hyd )

inline

References hyd_.

Member Data Documentation

std::string protocols::membrane::scoring::MEnvAtomParams::atom_type_name_

private

Referenced by atom_type_name().

core::Real protocols::membrane::scoring::MEnvAtomParams::dGfreeB_

private

Referenced by dGfreeB().

core::Real protocols::membrane::scoring::MEnvAtomParams::dGfreeW_

private

Referenced by dGfreeW().

core::Real protocols::membrane::scoring::MEnvAtomParams::hyd_

private

Referenced by hydration(), and set_hydration().

core::Real protocols::membrane::scoring::MEnvAtomParams::hyd_deriv_

private

Referenced by hydration_deriv().

numeric::xyzVector< core::Real > protocols::membrane::scoring::MEnvAtomParams::memb_coord_

private

Referenced by memb_coord().

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

• src/protocols/membrane/scoring/MEnvAtomParams.hh
• src/protocols/membrane/scoring/MEnvAtomParams.cc