RDKit
Open-source cheminformatics and machine learning.
RDKit::FMCS::SubstructureCache::HashKey Struct Reference

#include <SubstructureCache.h>

Public Member Functions

void computeKey (const Seed &seed, const std::vector< unsigned > &queryAtomLabels, const std::vector< unsigned > &queryBondLabels)
 

Public Attributes

KeyNumericMetrics NumericMetrics
 

Detailed Description

Definition at line 36 of file SubstructureCache.h.

Member Function Documentation

◆ computeKey()

void RDKit::FMCS::SubstructureCache::HashKey::computeKey ( const Seed seed,
const std::vector< unsigned > &  queryAtomLabels,
const std::vector< unsigned > &  queryBondLabels 
)
inline

Definition at line 40 of file SubstructureCache.h.

Referenced by RDKit::FMCS::SubstructureCache::find().

Member Data Documentation

◆ NumericMetrics

KeyNumericMetrics RDKit::FMCS::SubstructureCache::HashKey::NumericMetrics

The documentation for this struct was generated from the following file: