RDKit
Open-source cheminformatics and machine learning.
MolStandardize/Tautomer.h File Reference

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Classes

class  RDKit::MolStandardize::TautomerCanonicalizer
 
class  RDKit::MolStandardize::TautomerEnumerator
 

Namespaces

 RDKit
 Std stuff.
 
 RDKit::MolStandardize
 

Typedefs

typedef RDCatalog::HierarchCatalog< TautomerCatalogEntry, TautomerCatalogParams, int > RDKit::MolStandardize::TautomerCatalog
 

Functions

std::vector< std::pair< unsigned int, unsigned int > > RDKit::MolStandardize::pairwise (const std::vector< int > vect)