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root/group/trunk/OOPSE-4/src/io/OptionSectionParser.cpp
Revision: 2487
Committed: Mon Dec 5 22:23:57 2005 UTC (18 years, 7 months ago) by gezelter
File size: 3280 byte(s)
Log Message:
Adding handler for CLAY force field

File Contents

# Content
1 /*
2 * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved.
3 *
4 * The University of Notre Dame grants you ("Licensee") a
5 * non-exclusive, royalty free, license to use, modify and
6 * redistribute this software in source and binary code form, provided
7 * that the following conditions are met:
8 *
9 * 1. Acknowledgement of the program authors must be made in any
10 * publication of scientific results based in part on use of the
11 * program. An acceptable form of acknowledgement is citation of
12 * the article in which the program was described (Matthew
13 * A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher
14 * J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented
15 * Parallel Simulation Engine for Molecular Dynamics,"
16 * J. Comput. Chem. 26, pp. 252-271 (2005))
17 *
18 * 2. Redistributions of source code must retain the above copyright
19 * notice, this list of conditions and the following disclaimer.
20 *
21 * 3. Redistributions in binary form must reproduce the above copyright
22 * notice, this list of conditions and the following disclaimer in the
23 * documentation and/or other materials provided with the
24 * distribution.
25 *
26 * This software is provided "AS IS," without a warranty of any
27 * kind. All express or implied conditions, representations and
28 * warranties, including any implied warranty of merchantability,
29 * fitness for a particular purpose or non-infringement, are hereby
30 * excluded. The University of Notre Dame and its licensors shall not
31 * be liable for any damages suffered by licensee as a result of
32 * using, modifying or distributing the software or its
33 * derivatives. In no event will the University of Notre Dame or its
34 * licensors be liable for any lost revenue, profit or data, or for
35 * direct, indirect, special, consequential, incidental or punitive
36 * damages, however caused and regardless of the theory of liability,
37 * arising out of the use of or inability to use software, even if the
38 * University of Notre Dame has been advised of the possibility of
39 * such damages.
40 *
41 *
42 * OptionSectionParser.cpp
43 * OOPSE-2.0
44 *
45 * Created by Charles F. Vardeman II on 11/15/05.
46 * @author Charles F. Vardeman II
47 * @version $Id: OptionSectionParser.cpp,v 1.3 2005-12-05 22:23:57 gezelter Exp $
48 *
49 */
50
51 #include "io/OptionSectionParser.hpp"
52 #include "types/AtomType.hpp"
53 #include "UseTheForce/ForceField.hpp"
54 #include "utils/simError.h"
55 #include "utils/StringUtils.hpp"
56 namespace oopse {
57
58 OptionSectionParser::OptionSectionParser(ForceFieldOptions& options) : options_(options) {
59 setSectionName("Options");
60 }
61
62 void OptionSectionParser::parseLine(ForceField& ff,const std::string& line, int lineNo){
63
64 StringTokenizer tokenizer(line);
65
66 if (tokenizer.countTokens() >= 2) {
67 std::string optionName = tokenizer.nextToken();
68 std::string optionValue = tokenizer.nextToken();
69
70 options_.setData(optionName, optionValue);
71
72 } else {
73 sprintf(painCave.errMsg, "OptionSectionParser Error: Not enough tokens at line %d\n",
74 lineNo);
75 painCave.isFatal = 1;
76 simError();
77 }
78
79 }
80
81 void OptionSectionParser::validateSection() {
82 options_.validateOptions();
83 }
84
85 } //end namespace oopse