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RDKit
Open-source cheminformatics and machine learning.
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#include "FragCatParams.h"#include <RDGeneral/utils.h>#include <Catalogs/CatalogEntry.h>#include <GraphMol/RDKitBase.h>#include <GraphMol/Subgraphs/Subgraphs.h>#include <GraphMol/Subgraphs/SubgraphUtils.h>#include <GraphMol/SmilesParse/SmilesWrite.h>#include <GraphMol/Substruct/SubstructMatch.h>#include <map>#include <sstream>Go to the source code of this file.
Classes | |
| class | RDKit::FragCatalogEntry |
Namespaces | |
| RDKit | |
| Includes a bunch of functionality for handling Atom and Bond queries. | |