numeric::geometry::hashing::Ball Struct Reference

#include <xyzStripeHash.hh>

Public Member Functions
float &	x ()
float &	y ()
float &	z ()
float const &	x () const
float const &	y () const
float const &	z () const
xyzVector< Real >	xyz_real () const
xyzVector< float > const &	xyz () const
float	radius () const
void	radius (float radius)
Size	resi () const
Size	atomno () const

Public Attributes
float	x_
float	y_
float	z_
uint8_t	radius_
uint8_t	atomno_
uint16_t	resid_

Member Function Documentation

Size numeric::geometry::hashing::Ball::atomno ( ) const

inline

References atomno_.

Referenced by numeric::geometry::hashing::xyzStripeHash::clash_amount().

float numeric::geometry::hashing::Ball::radius ( ) const

inline

References radius_.

Referenced by numeric::geometry::hashing::xyzStripeHash::clash_check_ball(), numeric::geometry::hashing::xyzStripeHash::const_iterator::radius(), and numeric::geometry::hashing::xyzStripeHash::visit_lax().

void numeric::geometry::hashing::Ball::radius ( float  radius )

inline

References radius_.

Size numeric::geometry::hashing::Ball::resi ( ) const

inline

References resid_.

Referenced by numeric::geometry::hashing::xyzStripeHash::clash_amount(), numeric::geometry::hashing::xyzStripeHash::clash_check_residue_pairs(), and numeric::geometry::hashing::xyzStripeHash::resi().

float& numeric::geometry::hashing::Ball::x ( )

inline

References x_.

Referenced by numeric::geometry::hashing::xyzStripeHash::clash(), numeric::geometry::hashing::xyzStripeHash::clash_amount(), numeric::geometry::hashing::xyzStripeHash::clash_check_ball(), numeric::geometry::hashing::xyzStripeHash::clash_not_resid(), numeric::geometry::hashing::xyzStripeHash::clash_raw(), numeric::geometry::hashing::xyzStripeHash::fill_pairs(), numeric::geometry::hashing::xyzStripeHash::init(), numeric::geometry::hashing::xyzStripeHash::nbcount(), and numeric::geometry::hashing::xyzStripeHash::nbcount_raw().

float const& numeric::geometry::hashing::Ball::x ( ) const

inline

References x_.

xyzVector<float> const& numeric::geometry::hashing::Ball::xyz ( ) const

inline

Referenced by numeric::geometry::hashing::MinimalClashHash::clash_ball(), numeric::geometry::hashing::xyzStripeHash::clash_check_ball(), numeric::geometry::hashing::xyzStripeHash::debug_pdb(), and numeric::geometry::hashing::xyzStripeHash::xyz().

xyzVector<Real> numeric::geometry::hashing::Ball::xyz_real ( ) const

inline

References x_, y_, and z_.

float& numeric::geometry::hashing::Ball::y ( )

inline

References y_.

Referenced by numeric::geometry::hashing::xyzStripeHash::clash(), numeric::geometry::hashing::xyzStripeHash::clash_amount(), numeric::geometry::hashing::xyzStripeHash::clash_check_ball(), numeric::geometry::hashing::xyzStripeHash::clash_not_resid(), numeric::geometry::hashing::xyzStripeHash::clash_raw(), numeric::geometry::hashing::xyzStripeHash::fill_pairs(), numeric::geometry::hashing::xyzStripeHash::nbcount(), and numeric::geometry::hashing::xyzStripeHash::nbcount_raw().

float const& numeric::geometry::hashing::Ball::y ( ) const

inline

References y_.

float& numeric::geometry::hashing::Ball::z ( )

inline

References z_.

Referenced by numeric::geometry::hashing::xyzStripeHash::clash(), numeric::geometry::hashing::xyzStripeHash::clash_amount(), numeric::geometry::hashing::xyzStripeHash::clash_check_ball(), numeric::geometry::hashing::xyzStripeHash::clash_not_resid(), numeric::geometry::hashing::xyzStripeHash::clash_raw(), numeric::geometry::hashing::xyzStripeHash::fill_pairs(), numeric::geometry::hashing::xyzStripeHash::nbcount(), and numeric::geometry::hashing::xyzStripeHash::nbcount_raw().

float const& numeric::geometry::hashing::Ball::z ( ) const

inline

References z_.

Member Data Documentation

uint8_t numeric::geometry::hashing::Ball::atomno_

Referenced by atomno(), and numeric::geometry::hashing::operator<<().

uint8_t numeric::geometry::hashing::Ball::radius_

Referenced by numeric::geometry::hashing::operator<<(), and radius().

uint16_t numeric::geometry::hashing::Ball::resid_

Referenced by numeric::geometry::hashing::xyzStripeHash::clash_not_resid(), numeric::geometry::hashing::xyzStripeHash::fill_pairs(), numeric::geometry::hashing::operator<<(), and resi().

float numeric::geometry::hashing::Ball::x_

Referenced by numeric::geometry::hashing::operator<<(), x(), and xyz_real().

float numeric::geometry::hashing::Ball::y_

Referenced by numeric::geometry::hashing::operator<<(), xyz_real(), and y().

float numeric::geometry::hashing::Ball::z_

Referenced by numeric::geometry::hashing::operator<<(), xyz_real(), and z().

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

• src/numeric/geometry/hashing/xyzStripeHash.hh