CDPL.Pharm.FeatureGeometryMatchFunctor Class Reference

FeatureGeometryMatchFunctor. More...

Inheritance diagram for CDPL.Pharm.FeatureGeometryMatchFunctor:

Public Member Functions
None	__init__ (FeatureGeometryMatchFunctor func)
	Initializes a copy of the FeatureGeometryMatchFunctor instance func. More...
None	__init__ (float max_hba_int_dir_angle=85.0, float max_hba_orient_dev=45.0, float max_hbd_int_dir_dev=45.0, float max_xba_int_dir_dev=45.0, float max_xbd_int_dir_dev=45.0, float max_ar_orient_dev=45.0)
	Initializes the FeatureGeometryMatchFunctor instance. More...
int	getObjectID ()
	Returns the numeric identifier (ID) of the wrapped C++ class instance. More...
FeatureGeometryMatchFunctor	assign (FeatureGeometryMatchFunctor func)
	Replaces the current state of self with a copy of the state of the FeatureGeometryMatchFunctor instance func. More...
float	getMaxHBAInteractionDirAngle ()
None	setMaxHBAInteractionDirAngle (float angle)
float	getMaxHBAOrientationDeviation ()
None	setMaxHBAOrientationDeviation (float angle)
float	getMaxHBDInteractionDirDeviation ()
None	setMaxHBDInteractionDirDeviation (float angle)
float	getMaxXBAInteractionDirDeviation ()
None	setMaxXBAInteractionDirDeviation (float angle)
float	getMaxXBDInteractionDirDeviation ()
None	setMaxXBDInteractionDirDeviation (float angle)
float	getMaxAROrientationDeviation ()
None	setMaxAROrientationDeviation (float angle)
bool	__call__ (Feature ftr1, Feature ftr2)
	Calculates a score reflecting the goodness of the spatial feature orientation match. More...
bool	__call__ (Feature ftr1, Feature ftr2, Math.Matrix4D xform)
	Calculates a score reflecting the goodness of the spatial feature orientation match. More...

Static Public Attributes
float	DEF_MAX_HBA_INTERACTION_DIR_ANGLE = 85.0
float	DEF_MAX_HBA_ORIENTATION_DEVIATION = 45.0
float	DEF_MAX_HBD_INTERACTION_DIR_DEVIATION = 45.0
float	DEF_MAX_XBA_INTERACTION_DIR_DEVIATION = 45.0
float	DEF_MAX_XBD_INTERACTION_DIR_DEVIATION = 45.0
float	DEF_MAX_AR_ORIENTATION_DEVIATION = 45.0

Properties
	objectID = property(getObjectID)
	maxHBAInteractionDirAngle = property(getMaxHBAInteractionDirAngle, setMaxHBAInteractionDirAngle)
	maxHBAOrientationDeviation = property(getMaxHBAOrientationDeviation, setMaxHBAOrientationDeviation)
	maxHBDInteractionDirDeviation = property(getMaxHBDInteractionDirDeviation, setMaxHBDInteractionDirDeviation)
	maxXBDInteractionDirDeviation = property(getMaxXBDInteractionDirDeviation, setMaxXBDInteractionDirDeviation)
	maxXBAInteractionDirDeviation = property(getMaxXBAInteractionDirDeviation, setMaxXBAInteractionDirDeviation)
	maxAROrientationDeviation = property(getMaxAROrientationDeviation, setMaxAROrientationDeviation)

Detailed Description

FeatureGeometryMatchFunctor.

Constructor & Destructor Documentation

__init__() [1/2]

None CDPL.Pharm.FeatureGeometryMatchFunctor.__init__

(

FeatureGeometryMatchFunctor

func

)

Initializes a copy of the FeatureGeometryMatchFunctor instance func.

Parameters

func	The FeatureGeometryMatchFunctor instance to copy.

__init__() [2/2]

None CDPL.Pharm.FeatureGeometryMatchFunctor.__init__	(	float	max_hba_int_dir_angle = 85.0,
		float	max_hba_orient_dev = 45.0,
		float	max_hbd_int_dir_dev = 45.0,
		float	max_xba_int_dir_dev = 45.0,
		float	max_xbd_int_dir_dev = 45.0,
		float	max_ar_orient_dev = 45.0
	)

Initializes the FeatureGeometryMatchFunctor instance.

Parameters

max_hba_int_dir_angle
max_hba_orient_dev
max_hbd_int_dir_dev
max_xba_int_dir_dev
max_xbd_int_dir_dev
max_ar_orient_dev

Member Function Documentation

getObjectID()

int CDPL.Pharm.FeatureGeometryMatchFunctor.getObjectID

(

)

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

Different Python FeatureGeometryMatchFunctor 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 FeatureGeometryMatchFunctor 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.

assign()

FeatureGeometryMatchFunctor CDPL.Pharm.FeatureGeometryMatchFunctor.assign

(

FeatureGeometryMatchFunctor

func

)

Replaces the current state of self with a copy of the state of the FeatureGeometryMatchFunctor instance func.

Parameters

func	The FeatureGeometryMatchFunctor instance to copy.

Returns

self

getMaxHBAInteractionDirAngle()

float CDPL.Pharm.FeatureGeometryMatchFunctor.getMaxHBAInteractionDirAngle

(

)

Returns

setMaxHBAInteractionDirAngle()

None CDPL.Pharm.FeatureGeometryMatchFunctor.setMaxHBAInteractionDirAngle

(

float

angle

)

Parameters

angle

getMaxHBAOrientationDeviation()

float CDPL.Pharm.FeatureGeometryMatchFunctor.getMaxHBAOrientationDeviation

(

)

Returns

setMaxHBAOrientationDeviation()

None CDPL.Pharm.FeatureGeometryMatchFunctor.setMaxHBAOrientationDeviation

(

float

angle

)

Parameters

angle

getMaxHBDInteractionDirDeviation()

float CDPL.Pharm.FeatureGeometryMatchFunctor.getMaxHBDInteractionDirDeviation

(

)

Returns

setMaxHBDInteractionDirDeviation()

None CDPL.Pharm.FeatureGeometryMatchFunctor.setMaxHBDInteractionDirDeviation

(

float

angle

)

Parameters

angle

getMaxXBAInteractionDirDeviation()

float CDPL.Pharm.FeatureGeometryMatchFunctor.getMaxXBAInteractionDirDeviation

(

)

Returns

setMaxXBAInteractionDirDeviation()

None CDPL.Pharm.FeatureGeometryMatchFunctor.setMaxXBAInteractionDirDeviation

(

float

angle

)

Parameters

angle

getMaxXBDInteractionDirDeviation()

float CDPL.Pharm.FeatureGeometryMatchFunctor.getMaxXBDInteractionDirDeviation

(

)

Returns

setMaxXBDInteractionDirDeviation()

None CDPL.Pharm.FeatureGeometryMatchFunctor.setMaxXBDInteractionDirDeviation

(

float

angle

)

Parameters

angle

getMaxAROrientationDeviation()

float CDPL.Pharm.FeatureGeometryMatchFunctor.getMaxAROrientationDeviation

(

)

Returns

setMaxAROrientationDeviation()

None CDPL.Pharm.FeatureGeometryMatchFunctor.setMaxAROrientationDeviation

(

float

angle

)

Parameters

angle

__call__() [1/2]

bool CDPL.Pharm.FeatureGeometryMatchFunctor.__call__	(	Feature	ftr1,
		Feature	ftr2
	)

Calculates a score reflecting the goodness of the spatial feature orientation match.

Parameters

ftr1	The first feature.
ftr2	The second feature.

Returns

A score from 0 (=spatial deviation outside the allowed range) and 1 (optimum match) describing the goodness of the spatial orientation match of the two features.

__call__() [2/2]

bool CDPL.Pharm.FeatureGeometryMatchFunctor.__call__	(	Feature	ftr1,
		Feature	ftr2,
		Math.Matrix4D	xform
	)

Calculates a score reflecting the goodness of the spatial feature orientation match.

Parameters

ftr1	The first feature.
ftr2	The second feature.
xform	The transformation to apply to the spatial orientation of the second feature.

Returns

A score from 0 (=spatial deviation outside the allowed range) and 1 (optimum match) describing the goodness of the spatial orientation match of the two features.