#include <BALL/MOLMEC/CHARMM/charmmTorsion.h>

Public Member Functions
	SingleCharmmTorsion ()

	SingleCharmmTorsion (CosineTorsion::SingleData &t)

Public Attributes
Atom *	atom1

Atom *	atom2

Atom *	atom3

Atom *	atom4

float	V

unsigned char	f

float	phase

Detailed Description

Definition at line 48 of file charmmTorsion.h.

Constructor & Destructor Documentation

◆ SingleCharmmTorsion() [1/2]

BALL::CharmmTorsion::SingleCharmmTorsion::SingleCharmmTorsion ( )

inline

Definition at line 59 of file charmmTorsion.h.

◆ SingleCharmmTorsion() [2/2]

BALL::CharmmTorsion::SingleCharmmTorsion::SingleCharmmTorsion ( CosineTorsion::SingleData & t )

inline

Definition at line 70 of file charmmTorsion.h.

Member Data Documentation

◆ atom1

Atom* BALL::CharmmTorsion::SingleCharmmTorsion::atom1

Definition at line 50 of file charmmTorsion.h.

◆ atom2

Atom* BALL::CharmmTorsion::SingleCharmmTorsion::atom2

Definition at line 51 of file charmmTorsion.h.

◆ atom3

Atom* BALL::CharmmTorsion::SingleCharmmTorsion::atom3

Definition at line 52 of file charmmTorsion.h.

◆ atom4

Atom* BALL::CharmmTorsion::SingleCharmmTorsion::atom4

Definition at line 53 of file charmmTorsion.h.

◆ f

unsigned char BALL::CharmmTorsion::SingleCharmmTorsion::f

Definition at line 56 of file charmmTorsion.h.

◆ phase

float BALL::CharmmTorsion::SingleCharmmTorsion::phase

Definition at line 57 of file charmmTorsion.h.

◆ V

float BALL::CharmmTorsion::SingleCharmmTorsion::V

Definition at line 55 of file charmmTorsion.h.

Public Member Functions

Public Attributes