Chemical Data Processing Library C++ API - Version 1.1.1
CFLMoleculeReader.hpp
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1 /*
2  * CFLMoleculeReader.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_CFLMOLECULEREADER_HPP
30 #define CDPL_CONFGEN_CFLMOLECULEREADER_HPP
31 
32 #include <memory>
33 
36 
37 
38 namespace CDPL
39 {
40 
41  namespace Chem
42  {
43 
44  class Molecule;
45  }
46 
47  namespace ConfGen
48  {
49 
50  class CFLDataReader;
51 
55  class CDPL_CONFGEN_API CFLMoleculeReader : public Util::StreamDataReader<Chem::Molecule, CFLMoleculeReader>
56  {
57 
58  public:
64  CFLMoleculeReader(std::istream& is);
65 
70 
71  private:
72  friend class Util::StreamDataReader<Chem::Molecule, CFLMoleculeReader>;
73 
74  CFLMoleculeReader(const CFLMoleculeReader&);
75 
76  CFLMoleculeReader& operator=(const CFLMoleculeReader&);
77 
78  bool readData(std::istream&, Chem::Molecule&, bool overwrite);
79  bool skipData(std::istream&);
80  bool moreData(std::istream&);
81 
82  typedef std::unique_ptr<CFLDataReader> CFLDataReaderPtr;
83 
84  CFLDataReaderPtr reader;
85  };
86  } // namespace ConfGen
87 } // namespace CDPL
88 
89 #endif // CDPL_CONFGEN_CFLMOLECULEREADER_HPP
CDPL::ConfGen::CFLMoleculeReader
A reader for molecule data in the native I/O format of the CDPL.
Definition: CFLMoleculeReader.hpp:56
bool
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
The namespace of the Chemical Data Processing Library.
CDPL::ConfGen::CFLMoleculeReader::CFLMoleculeReader
CFLMoleculeReader(std::istream &is)
Constructs a CFLMoleculeReader instance that will read the molecule data from the input stream is.
StreamDataReader.hpp
Definition of the class CDPL::Util::StreamDataReader.
CDPL::Util::StreamDataReader
A helper class that implements Base::DataReader for std::istream based data readers.
Definition: StreamDataReader.hpp:73
CDPL::ConfGen::CFLMoleculeReader::~CFLMoleculeReader
~CFLMoleculeReader()
Destructor.