mirror of
https://github.com/rdkit/rdkit.git
synced 2026-06-04 21:54:27 +08:00
29 lines
706 B
C++
29 lines
706 B
C++
//
|
|
// Copyright (C) 2014 Novartis Institutes for BioMedical Research
|
|
//
|
|
// @@ All Rights Reserved @@
|
|
// This file is part of the RDKit.
|
|
// The contents are covered by the terms of the BSD license
|
|
// which is included in the file license.txt, found at the root
|
|
// of the RDKit source tree.
|
|
//
|
|
#include <RDGeneral/export.h>
|
|
#pragma once
|
|
#include <vector>
|
|
#include <stdexcept>
|
|
#include "../RDKitBase.h"
|
|
#include "Graph.h"
|
|
#include "MatchTable.h"
|
|
#include "DebugTrace.h" // algorithm filter definitions
|
|
|
|
namespace RDKit {
|
|
namespace FMCS {
|
|
struct Target {
|
|
const ROMol* Molecule;
|
|
Graph Topology;
|
|
MatchTable AtomMatchTable;
|
|
MatchTable BondMatchTable;
|
|
};
|
|
} // namespace FMCS
|
|
} // namespace RDKit
|