SubgraphUtils.h File Reference

#include "Subgraphs.h"
#include <boost/tuple/tuple.hpp>

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Namespaces
namespace	RDKit
namespace	RDKit::Subgraphs
Typedefs
typedef boost::tuples::tuple < double, double, double >	RDKit::Subgraphs::PathDiscrimTuple
Functions
PathDiscrimTuple	RDKit::Subgraphs::CalcPathDiscriminators (const ROMol &mol, const PATH_TYPE &path, bool useBO=true)
PATH_LIST	RDKit::Subgraphs::uniquifyPaths (const ROMol &mol, const PATH_LIST &allPathsb, bool useBO=true, double tol=1e-8)
PATH_TYPE	RDKit::Subgraphs::bondListFromAtomList (const ROMol &mol, const PATH_TYPE &atomIds)
ROMol *	RDKit::Subgraphs::PathToSubmol (const ROMol &mol, const PATH_TYPE &path, bool useQuery, std::map< int, int > &atomIdxMap)
ROMol *	RDKit::Subgraphs::PathToSubmol (const ROMol &mol, const PATH_TYPE &path, bool useQuery=false)