Package Chem :: Package Pharm2D :: Module Signature

Module Signature

data structures for holding 2D pharmacophore signatures


See Docs/Chem/Pharm2D.triangles.jpg for an illustration of the way
pharmacophores are broken into triangles and labelled.

See Docs/Chem/Pharm2D.signatures.jpg for an illustration of bit
numbering

Classes

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Pharm2DSig
**Notes on Use** - After any changes, the Init() method should be called **Important Attributes** - patterns: a list of SmartsPatterns used to determine the features patterns can be initialized directly from the list or from a list of SMARTS strings - bins: the list of distance bins to be used.

Variables

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_verbose = 0

_sigVersion = 100