BALL::HBondProcessor::HBond Class Reference

#include <BALL/STRUCTURE/HBondProcessor.h>

Public Member Functions
	HBond ()
	HBond (Atom const *acceptor, Atom const *donor, bool donor_is_hydrogen=false)
Atom const *	getAcceptor ()
Atom const *	getDonor ()
bool	donorIsHydrogen ()
	Return flag indicating what HBond definition was used.
float	getLength ()
	Return distance between donor and acceptor.

Protected Attributes
Atom const *	acceptor_
Atom const *	donor_
bool	donor_is_hydrogen_

Detailed Description

Class to represent a hydrogen bond.

Definition at line 110 of file HBondProcessor.h.

Constructor & Destructor Documentation

HBond() [1/2]

BALL::HBondProcessor::HBond::HBond

(

)

HBond() [2/2]

BALL::HBondProcessor::HBond::HBond ( Atom const * acceptor, Atom const * donor, bool donor_is_hydrogen = false )

inline

Definition at line 114 of file HBondProcessor.h.

Member Function Documentation

donorIsHydrogen()

bool BALL::HBondProcessor::HBond::donorIsHydrogen ( )

inline

Return flag indicating what HBond definition was used.

Definition at line 120 of file HBondProcessor.h.

getAcceptor()

Atom const * BALL::HBondProcessor::HBond::getAcceptor ( )

inline

Definition at line 116 of file HBondProcessor.h.

getDonor()

Atom const * BALL::HBondProcessor::HBond::getDonor ( )

inline

Definition at line 117 of file HBondProcessor.h.

getLength()

float BALL::HBondProcessor::HBond::getLength ( )

inline

Return distance between donor and acceptor.

Definition at line 123 of file HBondProcessor.h.

Member Data Documentation

acceptor_

Atom const* BALL::HBondProcessor::HBond::acceptor_

protected

Definition at line 128 of file HBondProcessor.h.

donor_

Atom const* BALL::HBondProcessor::HBond::donor_

protected

Definition at line 129 of file HBondProcessor.h.

donor_is_hydrogen_

bool BALL::HBondProcessor::HBond::donor_is_hydrogen_

protected

Definition at line 130 of file HBondProcessor.h.