RDKit
Open-source cheminformatics and machine learning.
MaximumCommonSubgraph.h File Reference
#include <vector>
#include <string>
#include <stdexcept>
#include "../RDKitBase.h"
#include "FMCS.h"
#include "DebugTrace.h"
#include "SeedSet.h"
#include "Target.h"
#include "SubstructureCache.h"
#include "DuplicatedSeedCache.h"
#include "MatchTable.h"
#include "TargetMatch.h"
#include "RingMatchTableSet.h"

Go to the source code of this file.

Classes

class  RDKit::FMCS::MaximumCommonSubgraph
 

Namespaces

 RDKit
 Includes a bunch of functionality for handling Atom and Bond queries.
 
 RDKit::FMCS
 

Functions

bool RDKit::FinalChiralityCheckFunction (const short unsigned c1[], const short unsigned c2[], const ROMol &mol1, const FMCS::Graph &query, const ROMol &mol2, const FMCS::Graph &target, const MCSParameters *p)