Chemical Data Processing Library C++ API - Version 1.1.1
TorsionLibrary.hpp
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1 /*
2  * TorsionLibrary.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_CONFGEN_TORSIONLIBRARY_HPP
30 #define CDPL_CONFGEN_TORSIONLIBRARY_HPP
31 
32 #include <iosfwd>
33 #include <memory>
34 
37 
38 
39 namespace CDPL
40 {
41 
42  namespace ConfGen
43  {
44 
46  {
47 
48  public:
49  typedef std::shared_ptr<TorsionLibrary> SharedPointer;
50 
51  void load(std::istream& is);
52 
53  void save(std::ostream& os) const;
54 
55  void loadDefaults();
56 
57  static void set(const SharedPointer& lib);
58 
59  static const SharedPointer& get();
60 
61  private:
62  static SharedPointer defaultLib;
63  };
64  } // namespace ConfGen
65 } // namespace CDPL
66 
67 #endif // CDPL_CONFGEN_TORSIONLIBRARY_HPP
TorsionCategory.hpp
Definition of the class CDPL::ConfGen::TorsionCategory.
CDPL::ConfGen::TorsionLibrary::get
static const SharedPointer & get()
CDPL::ConfGen::TorsionLibrary::SharedPointer
std::shared_ptr< TorsionLibrary > SharedPointer
Definition: TorsionLibrary.hpp:49
CDPL::ConfGen::TorsionLibrary
Definition: TorsionLibrary.hpp:46
APIPrefix.hpp
Definition of the preprocessor macro CDPL_CONFGEN_API.
CDPL_CONFGEN_API
#define CDPL_CONFGEN_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
CDPL::ConfGen::TorsionCategory
Definition: TorsionCategory.hpp:48
CDPL
The namespace of the Chemical Data Processing Library.
CDPL::ConfGen::TorsionLibrary::set
static void set(const SharedPointer &lib)
CDPL::ConfGen::TorsionLibrary::save
void save(std::ostream &os) const
CDPL::ConfGen::TorsionLibrary::loadDefaults
void loadDefaults()
CDPL::ConfGen::TorsionLibrary::load
void load(std::istream &is)