Chemical Data Processing Library Python API - Version 1.1.1
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IonicInteractionScore. More...
Public Member Functions | |
None | __init__ (IonicInteractionScore score) |
Initializes a copy of the IonicInteractionScore instance score. More... | |
None | __init__ (float min_dist=1.5, float max_dist=5.5) |
Constructs a IonicInteractionScore functor with a minimum ionic-feature pair distance of min_dist and a maximum distance of max_dist. More... | |
Public Member Functions inherited from CDPL.Pharm.FeatureDistanceScore | |
None | __init__ (FeatureDistanceScore score) |
Initializes a copy of the FeatureDistanceScore instance score. More... | |
None | setDistanceScoringFunction (DoubleDoubleFunctor func) |
float | getMinDistance () |
float | getMaxDistance () |
FeatureDistanceScore | assign (FeatureDistanceScore func) |
Replaces the current state of self with a copy of the state of the FeatureDistanceScore instance func. More... | |
Public Member Functions inherited from CDPL.Pharm.FeatureInteractionScore | |
None | __init__ () |
Initializes the FeatureInteractionScore instance. | |
int | getObjectID () |
Returns the numeric identifier (ID) of the wrapped C++ class instance. More... | |
float | __call__ (Feature arg2, Feature self) |
float | __call__ (Math.Vector3D arg2, Feature self) |
Static Public Attributes | |
float | DEF_MIN_DISTANCE = 1.5 |
float | DEF_MAX_DISTANCE = 5.5 |
Additional Inherited Members | |
Properties inherited from CDPL.Pharm.FeatureDistanceScore | |
minDistance = property(getMinDistance) | |
maxDistance = property(getMaxDistance) | |
Properties inherited from CDPL.Pharm.FeatureInteractionScore | |
objectID = property(getObjectID) | |
None CDPL.Pharm.IonicInteractionScore.__init__ | ( | IonicInteractionScore | score | ) |
Initializes a copy of the IonicInteractionScore instance score.
score | The IonicInteractionScore instance to copy. |
None CDPL.Pharm.IonicInteractionScore.__init__ | ( | float | min_dist = 1.5 , |
float | max_dist = 5.5 |
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Constructs a IonicInteractionScore
functor with a minimum ionic-feature pair distance of min_dist and a maximum distance of max_dist.
min_dist | The minimum allowed feature pair distance. |
max_dist | The maximum allowed feature pair distance. |
Reimplemented from CDPL.Pharm.FeatureDistanceScore.