Chemical Data Processing Library C++ API - Version 1.1.1
AtomMapping.hpp
Go to the documentation of this file.
1 /*
2  * AtomMapping.hpp
3  *
4  * This file is part of the Chemical Data Processing Toolkit
5  *
6  * Copyright (C) 2003 Thomas Seidel <thomas.seidel@univie.ac.at>
7  *
8  * This library is free software; you can redistribute it and/or
9  * modify it under the terms of the GNU Lesser General Public
10  * License as published by the Free Software Foundation; either
11  * version 2 of the License, or (at your option) any later version.
12  *
13  * This library is distributed in the hope that it will be useful,
14  * but WITHOUT ANY WARRANTY; without even the implied warranty of
15  * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
16  * Lesser General Public License for more details.
17  *
18  * You should have received a copy of the GNU Lesser General Public License
19  * along with this library; see the file COPYING. If not, write to
20  * the Free Software Foundation, Inc., 59 Temple Place - Suite 330,
21  * Boston, MA 02111-1307, USA.
22  */
23 
29 #ifndef CDPL_CHEM_ATOMMAPPING_HPP
30 #define CDPL_CHEM_ATOMMAPPING_HPP
31 
32 #include "CDPL/Chem/APIPrefix.hpp"
33 #include "CDPL/Util/MultiMap.hpp"
34 
35 
36 namespace CDPL
37 {
38 
39  namespace Chem
40  {
41 
42  class Atom;
43 
53  class CDPL_CHEM_API AtomMapping : public Util::MultiMap<const Atom*, const Atom*, true>
54  {
55 
56  public:
57  typedef std::shared_ptr<AtomMapping> SharedPointer;
58 
59  private:
60  const char* getClassName() const
61  {
62  return "AtomMapping";
63  }
64  };
65  } // namespace Chem
66 } // namespace CDPL
67 
68 #endif // CDPL_CHEM_ATOMMAPPING_HPP
APIPrefix.hpp
Definition of the preprocessor macro CDPL_CHEM_API.
CDPL_CHEM_API
#define CDPL_CHEM_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
CDPL::Chem::AtomMapping::SharedPointer
std::shared_ptr< AtomMapping > SharedPointer
Definition: AtomMapping.hpp:57
MultiMap.hpp
Definition of the class CDPL::Util::MultiMap.
CDPL::Chem::AtomMapping
A data type for the storage and lookup of arbitrary atom to atom mappings.
Definition: AtomMapping.hpp:54
CDPL::Util::MultiMap
A multiple sorted associative container that maps keys to values.
Definition: MultiMap.hpp:96
CDPL
The namespace of the Chemical Data Processing Library.