Package rdkit :: Package Chem :: Package Pharm3D :: Module Pharmacophore :: Class Pharmacophore

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# Class Pharmacophore

source code

Instance Methods | [hide private]

__init__(self, feats, initMats=True) | source code

_initializeFeats(self, feats) | source code

_initializeMatrices(self) | source code

getFeatures(self) | source code

getFeature(self, i) | source code

getUpperBound(self, i, j) | source code

getLowerBound(self, i, j) | source code

_checkBounds(self, i, j) raises ValueError on failure | source code

setUpperBound(self, i, j, val, checkBounds=False) | source code

setLowerBound(self, i, j, val, checkBounds=False) | source code

getUpperBound2D(self, i, j) | source code

getLowerBound2D(self, i, j) | source code

setUpperBound2D(self, i, j, val, checkBounds=False) | source code

setLowerBound2D(self, i, j, val, checkBounds=False) | source code

__str__(self) | source code