Package rdkit :: Package Chem :: Package FeatMaps :: Module FeatMaps :: Class FeatDirScoreMode

Class FeatDirScoreMode

object --+
         |
        FeatDirScoreMode

Instance Methods

[hide private]

Inherited from object: __delattr__, __format__, __getattribute__, __hash__, __init__, __new__, __reduce__, __reduce_ex__, __repr__, __setattr__, __sizeof__, __str__, __subclasshook__

Class Variables

[hide private]

Ignore = 0
ignore feature directions...

DotFullRange = 1
Use the dot product and allow negative contributions when directions are anti-parallel.

DotPosRange = 2
Use the dot product and scale contributions to lie between zero and one.

Properties

[hide private]

Inherited from object: __class__

Class Variable Details

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Ignore

ignore feature directions

Value:

DotFullRange

Use the dot product and allow negative contributions when
directions are anti-parallel.
e.g. score = dot(f1Dir,f2Dir)

Value:

DotPosRange

Use the dot product and scale contributions to lie between
zero and one.
e.g. score = ( dot(f1Dir,f2Dir) + 1 ) / 2

Value: