Package Chem :: Package Fingerprints :: Module SimilarityScreener

Module SimilarityScreener

class definitions for similarity screening

See _SimilarityScreener_ for overview of required API

Classes

[hide private]

SimilarityScreener
base class important attributes: probe: the probe fingerprint against which we screen.

ThresholdScreener
Used to return all compounds that have a similarity to the probe beyond a threshold value **Notes**: - This is as lazy as possible, so the data source isn't queried until the client asks for a hit.

TopNScreener
A screener that only returns the top N hits found...