Subset.h File Reference

#include <map>
#include <RDGeneral/export.h>
#include <boost/dynamic_bitset.hpp>
#include <memory>
#include <vector>

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Classes
struct	RDKit::SubsetOptions
	Subsetting Options for copyMolSubset. More...
struct	RDKit::SubsetInfo

Namespaces
namespace	RDKit
	Std stuff.

Enumerations
enum class	RDKit::SubsetMethod { RDKit::BONDS_BETWEEN_ATOMS , RDKit::BONDS = 1 }
	Subsetting Methods for copyMolSubset. More...

Functions
RDKIT_GRAPHMOL_EXPORT std::unique_ptr< RDKit::RWMol >	RDKit::copyMolSubset (const RDKit::ROMol &mol, const std::vector< unsigned int > &atoms, const std::vector< unsigned int > &bonds, const SubsetOptions &options=SubsetOptions())
RDKIT_GRAPHMOL_EXPORT std::unique_ptr< RDKit::RWMol >	RDKit::copyMolSubset (const RDKit::ROMol &mol, const std::vector< unsigned int > &atoms, const std::vector< unsigned int > &bonds, SubsetInfo &subsetInfo, const SubsetOptions &options=SubsetOptions())
RDKIT_GRAPHMOL_EXPORT std::unique_ptr< RDKit::RWMol >	RDKit::copyMolSubset (const RDKit::ROMol &mol, const std::vector< unsigned int > &path, const SubsetOptions &options=SubsetOptions())
RDKIT_GRAPHMOL_EXPORT std::unique_ptr< RDKit::RWMol >	RDKit::copyMolSubset (const RDKit::ROMol &mol, const std::vector< unsigned int > &path, SubsetInfo &subsetInfo, const SubsetOptions &options=SubsetOptions())