Chemical Data Processing Library Python API - Version 1.1.1
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Properties | |
objectID = property(getObjectID) | |
topMapping = property(getTopologicalMapping) | |
minTopologicalMappingSize = property(getMinTopologicalMappingSize, setMinTopologicalMappingSize) | |
exhaustiveSearch = property(exhaustiveSearchPerformed, performExhaustiveSearch) | |
transform = property(getTransform) | |
entityMatchFunction = property(getEntityMatchFunction, setEntityMatchFunction) | |
entityPairMatchFunction = property(getEntityPairMatchFunction, setEntityPairMatchFunction) | |
topAlignmentConstraintFunction = property(getTopAlignmentConstraintFunction, setTopAlignmentConstraintFunction) | |
entityCoordsFunction = property(getEntity3DCoordinatesFunction, setEntity3DCoordinatesFunction) | |
entityWeightFunction = property(getEntityWeightFunction, setEntityWeightFunction) | |
None CDPL.Pharm.SpatialFeatureAlignment.__init__ | ( | SpatialFeatureAlignment | alignment | ) |
Initializes a copy of the SpatialFeatureAlignment instance alignment.
alignment | The SpatialFeatureAlignment instance to copy. |
int CDPL.Pharm.SpatialFeatureAlignment.getObjectID | ( | ) |
Returns the numeric identifier (ID) of the wrapped C++ class instance.
Different Python SpatialFeatureAlignment 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 SpatialFeatureAlignment 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()
.
None CDPL.Pharm.SpatialFeatureAlignment.setEntityMatchFunction | ( | BoolFeature2Functor | func | ) |
func |
BoolFeature2Functor CDPL.Pharm.SpatialFeatureAlignment.getEntityMatchFunction | ( | ) |
None CDPL.Pharm.SpatialFeatureAlignment.setEntityPairMatchFunction | ( | BoolFeature4Functor | func | ) |
func |
BoolFeature4Functor CDPL.Pharm.SpatialFeatureAlignment.getEntityPairMatchFunction | ( | ) |
None CDPL.Pharm.SpatialFeatureAlignment.setTopAlignmentConstraintFunction | ( | Chem.BoolSTPairArrayFunctor | func | ) |
func |
Chem.BoolSTPairArrayFunctor CDPL.Pharm.SpatialFeatureAlignment.getTopAlignmentConstraintFunction | ( | ) |
None CDPL.Pharm.SpatialFeatureAlignment.setEntity3DCoordinatesFunction | ( | Feature3DCoordinatesFunction | func | ) |
func |
Feature3DCoordinatesFunction CDPL.Pharm.SpatialFeatureAlignment.getEntity3DCoordinatesFunction | ( | ) |
None CDPL.Pharm.SpatialFeatureAlignment.setEntityWeightFunction | ( | DoubleFeatureFunctor | func | ) |
func |
DoubleFeatureFunctor CDPL.Pharm.SpatialFeatureAlignment.getEntityWeightFunction | ( | ) |
None CDPL.Pharm.SpatialFeatureAlignment.performExhaustiveSearch | ( | bool | exhaustive | ) |
exhaustive |
bool CDPL.Pharm.SpatialFeatureAlignment.exhaustiveSearchPerformed | ( | ) |
None CDPL.Pharm.SpatialFeatureAlignment.addEntity | ( | Feature | entity, |
bool | first_set | ||
) |
entity | |
first_set |
None CDPL.Pharm.SpatialFeatureAlignment.clearEntities | ( | bool | first_set | ) |
first_set |
int CDPL.Pharm.SpatialFeatureAlignment.getNumEntities | ( | bool | first_set | ) |
first_set |
object CDPL.Pharm.SpatialFeatureAlignment.getEntities | ( | bool | first_set | ) |
first_set |
Feature CDPL.Pharm.SpatialFeatureAlignment.getEntity | ( | int | idx, |
bool | first_set | ||
) |
idx | |
first_set |
None CDPL.Pharm.SpatialFeatureAlignment.setMinTopologicalMappingSize | ( | int | min_size | ) |
min_size |
int CDPL.Pharm.SpatialFeatureAlignment.getMinTopologicalMappingSize | ( | ) |
None CDPL.Pharm.SpatialFeatureAlignment.reset | ( | ) |
reset |
bool CDPL.Pharm.SpatialFeatureAlignment.nextAlignment | ( | ) |
Math.Matrix4D CDPL.Pharm.SpatialFeatureAlignment.getTransform | ( | ) |
SpatialFeatureAlignment CDPL.Pharm.SpatialFeatureAlignment.assign | ( | SpatialFeatureAlignment | alignment | ) |
Replaces the current state of self with a copy of the state of the SpatialFeatureAlignment instance alignment.
alignment | The SpatialFeatureAlignment instance to copy. |
Util.STPairArray CDPL.Pharm.SpatialFeatureAlignment.getTopologicalMapping | ( | ) |