core::energy_methods::DisulfMinData Class Reference

Inheritance diagram for core::energy_methods::DisulfMinData:

Public Types
using	CacheableDataOP = basic::datacache::CacheableDataOP

Public Member Functions
	DisulfMinData (conformation::Residue const &res1, conformation::Residue const &res2)
	~DisulfMinData () override
CacheableDataOP	clone () const override
void	set_res_inds (Size which_res, core::scoring::disulfides::DisulfideAtomIndices const &dais)
	which_res should be 1 or 2 More...
core::scoring::disulfides::DisulfideAtomIndices const &	res_inds (Size which_res) const

Private Attributes
core::scoring::disulfides::DisulfideAtomIndices	res1_inds_
core::scoring::disulfides::DisulfideAtomIndices	res2_inds_

Member Typedef Documentation

using core::energy_methods::DisulfMinData::CacheableDataOP = basic::datacache::CacheableDataOP

Constructor & Destructor Documentation

core::energy_methods::DisulfMinData::DisulfMinData	(	conformation::Residue const &	res1,
		conformation::Residue const &	res2
	)

core::energy_methods::DisulfMinData::~DisulfMinData ( )

overridedefault

Member Function Documentation

DisulfMinData::CacheableDataOP core::energy_methods::DisulfMinData::clone ( ) const

override

core::scoring::disulfides::DisulfideAtomIndices const & core::energy_methods::DisulfMinData::res_inds

(

Size

which_res

)

const

References res1_inds_, and res2_inds_.

Referenced by core::energy_methods::FullatomDisulfideEnergy::eval_residue_pair_derivatives().

void core::energy_methods::DisulfMinData::set_res_inds	(	Size	which_res,
		core::scoring::disulfides::DisulfideAtomIndices const &	dais
	)

which_res should be 1 or 2

References res1_inds_, and res2_inds_.

Member Data Documentation

core::scoring::disulfides::DisulfideAtomIndices core::energy_methods::DisulfMinData::res1_inds_

private

Referenced by res_inds(), and set_res_inds().

core::scoring::disulfides::DisulfideAtomIndices core::energy_methods::DisulfMinData::res2_inds_

private

Referenced by res_inds(), and set_res_inds().

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

• src/core/energy_methods/FullatomDisulfideEnergy.cc