Chemical Data Processing Library C++ API - Version 1.1.1
PSDMoleculeInputHandler.hpp
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1 /*
2  * PSDMoleculeInputHandler.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_PHARM_PSDMOLECULEINPUTHANDLER_HPP
30 #define CDPL_PHARM_PSDMOLECULEINPUTHANDLER_HPP
31 
32 #include "CDPL/Pharm/APIPrefix.hpp"
34 
35 
36 namespace CDPL
37 {
38 
39  namespace Chem
40  {
41 
42  class Molecule;
43  }
44 
45  namespace Pharm
46  {
47 
52  {
53 
54  public:
56 
57  ReaderType::SharedPointer createReader(std::istream& is) const;
58 
59  ReaderType::SharedPointer createReader(const std::string& file_name, std::ios_base::openmode mode) const;
60  };
61  } // namespace Pharm
62 } // namespace CDPL
63 
64 #endif // CDPL_PHARM_PSDMOLECULEINPUTHANDLER_HPP
APIPrefix.hpp
Definition of the preprocessor macro CDPL_PHARM_API.
CDPL_PHARM_API
#define CDPL_PHARM_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
CDPL::Base::DataFormat
Provides meta-information about a particular data storage format.
Definition: Base/DataFormat.hpp:49
CDPL::Pharm::PSDMoleculeInputHandler
A handler for the input of molecule data in the PSD-format of the CDPL.
Definition: PSDMoleculeInputHandler.hpp:52
CDPL::Pharm::PSDMoleculeInputHandler::createReader
ReaderType::SharedPointer createReader(std::istream &is) const
Creates a Base::DataReader instance that will read the data from the input stream is.
DataInputHandler.hpp
Definition of the class CDPL::Base::DataInputHandler.
CDPL::Base::DataReader< Chem::Molecule >::SharedPointer
std::shared_ptr< DataReader > SharedPointer
A reference-counted smart pointer [SHPTR] for dynamically allocated DataReader instances.
Definition: DataReader.hpp:84
CDPL
The namespace of the Chemical Data Processing Library.
CDPL::Base::DataInputHandler
A factory interface providing methods for the creation of Base::DataReader instances handling a parti...
Definition: DataInputHandler.hpp:54
CDPL::Pharm::PSDMoleculeInputHandler::getDataFormat
const Base::DataFormat & getDataFormat() const
CDPL::Pharm::PSDMoleculeInputHandler::createReader
ReaderType::SharedPointer createReader(const std::string &file_name, std::ios_base::openmode mode) const
Creates a Base::DataReader instance that will read the data from the file specified by file_name.