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Chemical Data Processing Library Python API - Version 1.2.3
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Public Member Functions | |
None | __init__ () |
Initializes the DVectorBulkSimilarityCalculator instance. | |
None | __init__ (DVectorBulkSimilarityCalculator calc) |
Initializes a copy of the DVectorBulkSimilarityCalculator instance calc. More... | |
None | __init__ (Math.DoubleDVector2Functor sim_func) |
Initializes the DVectorBulkSimilarityCalculator instance. More... | |
int | getObjectID () |
Returns the numeric identifier (ID) of the wrapped C++ class instance. More... | |
DVectorBulkSimilarityCalculator | assign (DVectorBulkSimilarityCalculator calc) |
Replaces the current state of self with a copy of the state of the DVectorBulkSimilarityCalculator instance calc. More... | |
None | setSimilarityFunction (Math.DoubleDVector2Functor func) |
Math.DoubleDVector2Functor | getSimilarityFunction () |
None | clear () |
int | getNumDescriptors () |
None | addDescriptor (Math.DVector descr) |
bool | containsDescriptor (Math.DVector descr) |
Math.DVector | getDescriptor (int idx) |
None | removeDescriptor (int idx) |
None | calculate (Math.DVector descr, bool sort=False, bool sort_desc=True) |
tuple | getResult (int idx) |
float | getSimilarity (int idx) |
int | getDescriptorIndex (int idx) |
tuple | __getitem__ (int idx) |
bool | __contains__ (Math.DVector descr) |
Returns the result of the membership test operation descr in self . More... | |
Properties | |
objectID = property(getObjectID) | |
numDescriptors = property(getNumDescriptors) | |
similarityFunc = property(getSimilarityFunction, setSimilarityFunction) | |
None CDPL.Descr.DVectorBulkSimilarityCalculator.__init__ | ( | DVectorBulkSimilarityCalculator | calc | ) |
Initializes a copy of the DVectorBulkSimilarityCalculator instance calc.
calc | The DVectorBulkSimilarityCalculator instance to copy. |
None CDPL.Descr.DVectorBulkSimilarityCalculator.__init__ | ( | Math.DoubleDVector2Functor | sim_func | ) |
Initializes the DVectorBulkSimilarityCalculator instance.
sim_func |
int CDPL.Descr.DVectorBulkSimilarityCalculator.getObjectID | ( | ) |
Returns the numeric identifier (ID) of the wrapped C++ class instance.
Different Python DVectorBulkSimilarityCalculator
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 DVectorBulkSimilarityCalculator
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()
.
DVectorBulkSimilarityCalculator CDPL.Descr.DVectorBulkSimilarityCalculator.assign | ( | DVectorBulkSimilarityCalculator | calc | ) |
Replaces the current state of self with a copy of the state of the DVectorBulkSimilarityCalculator
instance calc.
calc | The DVectorBulkSimilarityCalculator instance to copy. |
None CDPL.Descr.DVectorBulkSimilarityCalculator.setSimilarityFunction | ( | Math.DoubleDVector2Functor | func | ) |
func |
Math.DoubleDVector2Functor CDPL.Descr.DVectorBulkSimilarityCalculator.getSimilarityFunction | ( | ) |
int CDPL.Descr.DVectorBulkSimilarityCalculator.getNumDescriptors | ( | ) |
None CDPL.Descr.DVectorBulkSimilarityCalculator.addDescriptor | ( | Math.DVector | descr | ) |
descr |
bool CDPL.Descr.DVectorBulkSimilarityCalculator.containsDescriptor | ( | Math.DVector | descr | ) |
descr |
Math.DVector CDPL.Descr.DVectorBulkSimilarityCalculator.getDescriptor | ( | int | idx | ) |
idx |
None CDPL.Descr.DVectorBulkSimilarityCalculator.removeDescriptor | ( | int | idx | ) |
idx |
None CDPL.Descr.DVectorBulkSimilarityCalculator.calculate | ( | Math.DVector | descr, |
bool | sort = False , |
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bool | sort_desc = True |
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) |
descr | |
sort | |
sort_desc |
tuple CDPL.Descr.DVectorBulkSimilarityCalculator.getResult | ( | int | idx | ) |
idx |
float CDPL.Descr.DVectorBulkSimilarityCalculator.getSimilarity | ( | int | idx | ) |
idx |
int CDPL.Descr.DVectorBulkSimilarityCalculator.getDescriptorIndex | ( | int | idx | ) |
idx |
tuple CDPL.Descr.DVectorBulkSimilarityCalculator.__getitem__ | ( | int | idx | ) |
idx |
bool CDPL.Descr.DVectorBulkSimilarityCalculator.__contains__ | ( | Math.DVector | descr | ) |
Returns the result of the membership test operation descr in self
.
descr | The value to test for membership. |