RDKit
Open-source cheminformatics and machine learning.
RDKit::FMCS::Graph Class Reference

#include <Graph.h>

Inheritance diagram for RDKit::FMCS::Graph:

Public Types

typedef edge_iterator EDGE_ITER
 
typedef std::pair< EDGE_ITER, EDGE_ITERBOND_ITER_PAIR
 

Public Member Functions

void addAtom (unsigned atom)
 
void addBond (unsigned bond, unsigned beginAtom, unsigned endAtom)
 

Detailed Description

Definition at line 22 of file Graph.h.

Member Typedef Documentation

Definition at line 25 of file Graph.h.

typedef edge_iterator RDKit::FMCS::Graph::EDGE_ITER

Definition at line 24 of file Graph.h.

Member Function Documentation

void RDKit::FMCS::Graph::addAtom ( unsigned  atom)
inline

Definition at line 27 of file Graph.h.

Referenced by RDKit::FMCS::RingMatchTableSet::computeRingMatchTable().

void RDKit::FMCS::Graph::addBond ( unsigned  bond,
unsigned  beginAtom,
unsigned  endAtom 
)
inline

Definition at line 31 of file Graph.h.

Referenced by RDKit::FMCS::RingMatchTableSet::computeRingMatchTable().


The documentation for this class was generated from the following file: