CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable Class Reference

Inheritance diagram for CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable:

Classes
class	Entry

Public Member Functions
None	__init__ ()
	Initializes the MMFF94OutOfPlaneBendingParameterTable instance.
None	__init__ (MMFF94OutOfPlaneBendingParameterTable table)
	Initializes a copy of the MMFF94OutOfPlaneBendingParameterTable instance table. More...
int	getObjectID ()
	Returns the numeric identifier (ID) of the wrapped C++ class instance. More...
None	addEntry (int term_atom1_type, int ctr_atom_type, int term_atom2_type, int oop_atom_type, float force_const)
bool	removeEntry (int term_atom1_type, int ctr_atom_type, int term_atom2_type, int oop_atom_type)
Entry	getEntry (int term_atom1_type, int ctr_atom_type, int term_atom2_type, int oop_atom_type)
None	clear ()
int	getNumEntries ()
list	getEntries ()
None	load (Base.IStream is)
None	loadDefaults (int param_set)
MMFF94OutOfPlaneBendingParameterTable	assign (MMFF94OutOfPlaneBendingParameterTable table)
	Replaces the current state of self with a copy of the state of the MMFF94OutOfPlaneBendingParameterTable instance table. More...

Static Public Member Functions
None	set (MMFF94OutOfPlaneBendingParameterTable table, int param_set)
MMFF94OutOfPlaneBendingParameterTable	get (int param_set)

Properties
	objectID = property(getObjectID)
	numEntries = property(getNumEntries)
	entries = property(getEntries)

Constructor & Destructor Documentation

__init__()

None CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.__init__

(

MMFF94OutOfPlaneBendingParameterTable

table

)

Initializes a copy of the MMFF94OutOfPlaneBendingParameterTable instance table.

Parameters

table

The MMFF94OutOfPlaneBendingParameterTable instance to copy.

Member Function Documentation

getObjectID()

int CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.getObjectID

(

)

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

Different Python MMFF94OutOfPlaneBendingParameterTable 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 MMFF94OutOfPlaneBendingParameterTable 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.

addEntry()

None CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.addEntry	(	int	term_atom1_type,
		int	ctr_atom_type,
		int	term_atom2_type,
		int	oop_atom_type,
		float	force_const
	)

Parameters

term_atom1_type
ctr_atom_type
term_atom2_type
oop_atom_type
force_const

removeEntry()

bool CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.removeEntry	(	int	term_atom1_type,
		int	ctr_atom_type,
		int	term_atom2_type,
		int	oop_atom_type
	)

Parameters

term_atom1_type
ctr_atom_type
term_atom2_type
oop_atom_type

Returns

getEntry()

Entry CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.getEntry	(	int	term_atom1_type,
		int	ctr_atom_type,
		int	term_atom2_type,
		int	oop_atom_type
	)

Parameters

term_atom1_type
ctr_atom_type
term_atom2_type
oop_atom_type

Returns

getNumEntries()

int CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.getNumEntries

(

)

Returns

getEntries()

list CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.getEntries

(

)

Returns

load()

None CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.load

(

Base.IStream

is

)

Parameters

is

loadDefaults()

None CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.loadDefaults

(

int

param_set

)

Parameters

param_set

assign()

MMFF94OutOfPlaneBendingParameterTable CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.assign

(

MMFF94OutOfPlaneBendingParameterTable

table

)

Replaces the current state of self with a copy of the state of the MMFF94OutOfPlaneBendingParameterTable instance table.

Parameters

table

The MMFF94OutOfPlaneBendingParameterTable instance to copy.

Returns

self

set()

None CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.set ( MMFF94OutOfPlaneBendingParameterTable  table, int  param_set  )

static

Parameters

table
param_set

get()

MMFF94OutOfPlaneBendingParameterTable CDPL.ForceField.MMFF94OutOfPlaneBendingParameterTable.get ( int  param_set )

static

Parameters

param_set

Returns