protocols::simple_moves::AtomHash Class Reference

#include <ExplicitWaterMover.hh>

Public Member Functions
	AtomHash ()
	AtomHash (core::Real bindis)
void	add_point (core::Size residx, core::Vector xyz)
core::Size	get_neighborcount (core::Vector xyz, core::Real dlim)
void	trim_to_heterogeneous_clusters (core::Real dlim)
void	reset_and_get_clusters (utility::vector1< utility::vector1< core::Vector > > &clusters, core::Real dredundant, core::Real dcluster)
int	npoints ()

Private Attributes
std::unordered_multimap< int, AtomHashNode >	nodes_
core::Real	bindis_

Constructor & Destructor Documentation

protocols::simple_moves::AtomHash::AtomHash ( )

inline

References bindis_.

protocols::simple_moves::AtomHash::AtomHash ( core::Real  bindis )

inline

References bindis_.

Member Function Documentation

void protocols::simple_moves::AtomHash::add_point	(	core::Size	residx,
		core::Vector	xyz
	)

References bindis_, protocols::simple_moves::AtomHashNode::idx, nodes_, protocols::simple_moves::AtomHashNode::residx, protocols::kinmatch::xyz(), and protocols::simple_moves::AtomHashNode::xyz.

Referenced by protocols::simple_moves::ExplicitWaterMover::build_lkboverlap_rotamer_clouds(), and trim_to_heterogeneous_clusters().

core::Size protocols::simple_moves::AtomHash::get_neighborcount	(	core::Vector	xyz,
		core::Real	dlim
	)

References bindis_, nodes_, and protocols::kinmatch::xyz().

int protocols::simple_moves::AtomHash::npoints ( )

inline

References nodes_.

Referenced by protocols::simple_moves::ExplicitWaterMover::build_lkboverlap_rotamer_clouds().

void protocols::simple_moves::AtomHash::reset_and_get_clusters	(	utility::vector1< utility::vector1< core::Vector > > &	clusters,
		core::Real	dredundant,
		core::Real	dcluster
	)

References bindis_, protocols::mean_field::max(), and nodes_.

Referenced by protocols::simple_moves::ExplicitWaterMover::build_lkboverlap_rotamer_clouds().

void protocols::simple_moves::AtomHash::trim_to_heterogeneous_clusters

(

core::Real

dlim

)

References add_point(), bindis_, and nodes_.

Referenced by protocols::simple_moves::ExplicitWaterMover::build_lkboverlap_rotamer_clouds().

Member Data Documentation

core::Real protocols::simple_moves::AtomHash::bindis_

private

Referenced by add_point(), AtomHash(), get_neighborcount(), reset_and_get_clusters(), and trim_to_heterogeneous_clusters().

std::unordered_multimap< int, AtomHashNode > protocols::simple_moves::AtomHash::nodes_

private

Referenced by add_point(), get_neighborcount(), npoints(), reset_and_get_clusters(), and trim_to_heterogeneous_clusters().

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

• src/protocols/simple_moves/ExplicitWaterMover.hh
• src/protocols/simple_moves/ExplicitWaterMover.cc