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RDKit
Open-source cheminformatics and machine learning.
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#include <RDGeneral/export.h>#include <string>#include <Catalogs/Catalog.h>#include <GraphMol/MolStandardize/TautomerCatalog/TautomerCatalogEntry.h>#include <GraphMol/MolStandardize/TautomerCatalog/TautomerCatalogParams.h>Go to the source code of this file.
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) |