RDKit
Open-source cheminformatics and machine learning.
FilterCatalog.h File Reference

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Classes

class  RDKit::FilterCatalogParams
 
class  RDKit::FilterCatalog
 

Namespaces

 RDKit
 Std stuff.
 

Typedefs

typedef RDCatalog::Catalog< FilterCatalogEntry, FilterCatalogParams > RDKit::FCatalog
 

Functions

RDKIT_FILTERCATALOG_EXPORT bool RDKit::FilterCatalogCanSerialize ()
 
RDKIT_FILTERCATALOG_EXPORT std::vector< std::vector< boost::shared_ptr< const FilterCatalogEntry > > > RDKit::RunFilterCatalog (const FilterCatalog &filterCatalog, const std::vector< std::string > &smiles, int numThreads=1)
 Run a filter catalog on a set of smiles strings. More...