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root/group/branches/new_design/OOPSE-4/src/io/TorsionTypesSectionParser.hpp
Revision: 1799
Committed: Tue Nov 30 03:49:22 2004 UTC (19 years, 7 months ago) by tim
File size: 2081 byte(s)
Log Message:
minor fixed

File Contents

# Content
1 /*
2 * Copyright (C) 2000-2004 Object Oriented Parallel Simulation Engine (OOPSE) project
3 *
4 * Contact: oopse@oopse.org
5 *
6 * This program is free software; you can redistribute it and/or
7 * modify it under the terms of the GNU Lesser General Public License
8 * as published by the Free Software Foundation; either version 2.1
9 * of the License, or (at your option) any later version.
10 * All we ask is that proper credit is given for our work, which includes
11 * - but is not limited to - adding the above copyright notice to the beginning
12 * of your source code files, and to any copyright notice that you may distribute
13 * with programs based on this work.
14 *
15 * This program is distributed in the hope that it will be useful,
16 * but WITHOUT ANY WARRANTY; without even the implied warranty of
17 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
18 * GNU Lesser General Public License for more details.
19 *
20 * You should have received a copy of the GNU Lesser General Public License
21 * along with this program; if not, write to the Free Software
22 * Foundation, Inc., 59 Temple Place - Suite 330, Boston, MA 02111-1307, USA.
23 *
24 */
25
26 #ifndef IO_TORSIONTYPESSECTIONPARSER_HPP
27 #define IO_TORSIONTYPESSECTIONPARSER_HPP
28 #include <map>
29 #include "io/SectionParser.hpp"
30 namespace oopse {
31
32 /**
33 * @class TorsionTypesSectionParser TorsionTypesSectionParser.hpp "io/TorsionTypesSectionParser.hpp"
34 */
35 class TorsionTypesSectionParser : public SectionParser {
36 public:
37
38
39 TorsionTypesSectionParser();
40 private:
41
42
43 enum TorsionTypeEnum{
44 ttCubic,
45 ttQuartic,
46 ttPolynomial,
47 ttCharmm,
48 ttUnknown
49 };
50
51 TorsionTypeEnum getTorsionTypeEnum(const std::string& str);
52
53 void parseLine(ForceField& ff, const std::string& line, int lineNo);
54
55
56 std::map<std::string, TorsionTypeEnum> stringToEnumMap_;
57 };
58
59
60 } //namespace oopse
61
62 #endif //IO_TORSIONTYPESSECTIONPARSER_HPP
63
64
65
66