rdkit.Chem.Fingerprints.SimilarityScreener

Package rdkit :: Package Chem :: Package Fingerprints :: Module SimilarityScreener |
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# Module SimilarityScreener

source code

    class definitions for similarity screening

    See _SimilarityScreener_ for overview of required API

Classes | [hide private]
| SimilarityScreener base class
| ThresholdScreener Used to return all compounds that have a similarity to the probe beyond a threshold value
| TopNScreener A screener that only returns the top N hits found

Imports: DataStructs, TopNContainer, RDConfig