Matched Pair analysis using a multi-threaded generation of a MMP index

A program that performs a multi-threaded matched pair analysis of a set of structures for indexing and saves the generated index file for subsequent loading and querying.

Schematic representation of the Matched Pair Analysis process

See also

• OEMatchedPairAnalyzer class

• OEMatchedPairAnalyzerOptions class

• OEMatchedPairApplyTransforms function

Command Line Interface

prompt> CreateMMPIndexThreaded.py [ -threads num_threads ] index.sdf output.mmpidx

Code

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CreateMMPIndexThreaded.py