GridWeights Class Reference

Public Member Functions
	GridWeights (core::Real const &atr, core::Real const &rep, core::Real const &vdw, core::Real const &hba, core::Real const &hbd)
core::optimization::Multivec	get_multivec ()
std::map< std::string, core::Size >	get_indices ()
core::Real	atr () const
core::Real	rep () const
core::Real	vdw () const
core::Real	hba () const
core::Real	hbd () const

Private Attributes
core::Real	atr_
core::Real	rep_
core::Real	vdw_
core::Real	hba_
core::Real	hbd_

Constructor & Destructor Documentation

GridWeights()

GridWeights::GridWeights ( core::Real const &  atr, core::Real const &  rep, core::Real const &  vdw, core::Real const &  hba, core::Real const &  hbd  )

inline

Member Function Documentation

atr()

core::Real GridWeights::atr ( ) const

inline

Referenced by main().

get_indices()

std::map<std::string,core::Size> GridWeights::get_indices ( )

inline

Referenced by main().

get_multivec()

core::optimization::Multivec GridWeights::get_multivec ( )

inline

Referenced by main().

hba()

core::Real GridWeights::hba ( ) const

inline

Referenced by main().

hbd()

core::Real GridWeights::hbd ( ) const

inline

Referenced by main().

rep()

core::Real GridWeights::rep ( ) const

inline

Referenced by main().

vdw()

core::Real GridWeights::vdw ( ) const

inline

Referenced by main().

Member Data Documentation

atr_

core::Real GridWeights::atr_

private

hba_

core::Real GridWeights::hba_

private

hbd_

core::Real GridWeights::hbd_

private

rep_

core::Real GridWeights::rep_

private

vdw_

core::Real GridWeights::vdw_

private

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

• src/apps/pilot/delucasl/roc_optimizer.cc