CDPL.Shape.ScreeningProcessor Class Reference

Inheritance diagram for CDPL.Shape.ScreeningProcessor:

Public Member Functions
None	__init__ ()
	Initializes the ScreeningProcessor instance.
None	__init__ (Chem.MolecularGraph query)
	Initializes the ScreeningProcessor instance. More...
int	getObjectID ()
	Returns the numeric identifier (ID) of the wrapped C++ class instance. More...
None	setHitCallback (VoidMolecularGraph2AlignmentResultFunctor func)
VoidMolecularGraph2AlignmentResultFunctor	getHitCallback ()
ScreeningSettings	getSettings ()
None	clearQuerySet ()
None	addQuery (Chem.MolecularGraph molgraph)
int	getQuerySetSize ()
Chem.MolecularGraph	getQuery (int idx)
bool	process (Chem.MolecularGraph molgraph)

Properties
	objectID = property(getObjectID)
	hitCallback = property(getHitCallback, setHitCallback)
	settings = property(getSettings)
	querySetSize = property(getQuerySetSize)

Constructor & Destructor Documentation

__init__()

None CDPL.Shape.ScreeningProcessor.__init__

(

Chem.MolecularGraph

query

)

Initializes the ScreeningProcessor instance.

Parameters

query

Member Function Documentation

getObjectID()

int CDPL.Shape.ScreeningProcessor.getObjectID

(

)

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

Different Python ScreeningProcessor 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 ScreeningProcessor 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.

setHitCallback()

None CDPL.Shape.ScreeningProcessor.setHitCallback

(

VoidMolecularGraph2AlignmentResultFunctor

func

)

Parameters

func

getHitCallback()

VoidMolecularGraph2AlignmentResultFunctor CDPL.Shape.ScreeningProcessor.getHitCallback

(

)

Returns

getSettings()

ScreeningSettings CDPL.Shape.ScreeningProcessor.getSettings

(

)

Returns

addQuery()

None CDPL.Shape.ScreeningProcessor.addQuery

(

Chem.MolecularGraph

molgraph

)

Parameters

molgraph

getQuerySetSize()

int CDPL.Shape.ScreeningProcessor.getQuerySetSize

(

)

Returns

getQuery()

Chem.MolecularGraph CDPL.Shape.ScreeningProcessor.getQuery

(

int

idx

)

Parameters

idx

Returns

process()

bool CDPL.Shape.ScreeningProcessor.process

(

Chem.MolecularGraph

molgraph

)

Parameters

molgraph

Returns