CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction Class Reference

Inheritance diagram for CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction:

Public Member Functions
None	__init__ (MMFF94OutOfPlaneBendingInteraction iactn)
	Initializes a copy of the MMFF94OutOfPlaneBendingInteraction instance iactn. More...
None	__init__ (int term_atom1_idx, int ctr_atom_idx, int term_atom2_idx, int oop_atom_idx, float force_const)
	Initializes the MMFF94OutOfPlaneBendingInteraction instance. More...
int	getTerminalAtom1Index ()
int	getTerminalAtom2Index ()
int	getCenterAtomIndex ()
int	getOutOfPlaneAtomIndex ()
int	getAtom1Index ()
int	getAtom2Index ()
int	getAtom3Index ()
int	getAtom4Index ()
float	getForceConstant ()
MMFF94OutOfPlaneBendingInteraction	assign (MMFF94OutOfPlaneBendingInteraction iactn)
	Replaces the current state of self with a copy of the state of the MMFF94OutOfPlaneBendingInteraction instance iactn. More...
int	getObjectID ()
	Returns the numeric identifier (ID) of the wrapped C++ class instance. More...

Properties
	objectID = property(getObjectID)
	termAtom1Index = property(getTerminalAtom1Index)
	termAtom2Index = property(getTerminalAtom2Index)
	ctrAtomIndex = property(getCenterAtomIndex)
	oopAtomIndex = property(getOutOfPlaneAtomIndex)
	atom1Index = property(getAtom1Index)
	atom2Index = property(getAtom2Index)
	atom3Index = property(getAtom3Index)
	atom4Index = property(getAtom4Index)
	forceConstant = property(getForceConstant)

Constructor & Destructor Documentation

__init__() [1/2]

None CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.__init__

(

MMFF94OutOfPlaneBendingInteraction

iactn

)

Initializes a copy of the MMFF94OutOfPlaneBendingInteraction instance iactn.

Parameters

iactn

The MMFF94OutOfPlaneBendingInteraction instance to copy.

__init__() [2/2]

None CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.__init__	(	int	term_atom1_idx,
		int	ctr_atom_idx,
		int	term_atom2_idx,
		int	oop_atom_idx,
		float	force_const
	)

Initializes the MMFF94OutOfPlaneBendingInteraction instance.

Parameters

term_atom1_idx
ctr_atom_idx
term_atom2_idx
oop_atom_idx
force_const

Member Function Documentation

getTerminalAtom1Index()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getTerminalAtom1Index

(

)

Returns

getTerminalAtom2Index()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getTerminalAtom2Index

(

)

Returns

getCenterAtomIndex()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getCenterAtomIndex

(

)

Returns

getOutOfPlaneAtomIndex()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getOutOfPlaneAtomIndex

(

)

Returns

getAtom1Index()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getAtom1Index

(

)

Returns

getAtom2Index()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getAtom2Index

(

)

Returns

getAtom3Index()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getAtom3Index

(

)

Returns

getAtom4Index()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getAtom4Index

(

)

Returns

getForceConstant()

float CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getForceConstant

(

)

Returns

assign()

MMFF94OutOfPlaneBendingInteraction CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.assign

(

MMFF94OutOfPlaneBendingInteraction

iactn

)

Replaces the current state of self with a copy of the state of the MMFF94OutOfPlaneBendingInteraction instance iactn.

Parameters

iactn

The MMFF94OutOfPlaneBendingInteraction instance to copy.

Returns

self

getObjectID()

int CDPL.ForceField.MMFF94OutOfPlaneBendingInteraction.getObjectID

(

)

Returns the numeric identifier (ID) of the wrapped C++ class instance.

Different Python MMFF94OutOfPlaneBendingInteraction instances may reference the same underlying C++ class instance. The commonly used Python expression a is not b thus cannot tell reliably whether the two MMFF94OutOfPlaneBendingInteraction instances a and b reference different C++ objects. The numeric identifier returned by this method allows to correctly implement such an identity test via the simple expression a.getObjectID() != b.getObjectID().

Returns

The numeric ID of the internally referenced C++ class instance.