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Comparing trunk/src/visitors/OtherVisitor.hpp (file contents):
Revision 543 by tim, Thu May 26 22:45:00 2005 UTC vs.
Revision 1455 by gezelter, Thu Jun 24 20:44:18 2010 UTC

# Line 6 | Line 6
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
9 > * 1. Redistributions of source code must retain the above copyright
10   *    notice, this list of conditions and the following disclaimer.
11   *
12 < * 3. Redistributions in binary form must reproduce the above copyright
12 > * 2. Redistributions in binary form must reproduce the above copyright
13   *    notice, this list of conditions and the following disclaimer in the
14   *    documentation and/or other materials provided with the
15   *    distribution.
# Line 37 | Line 28
28   * arising out of the use of or inability to use software, even if the
29   * University of Notre Dame has been advised of the possibility of
30   * such damages.
31 + *
32 + * SUPPORT OPEN SCIENCE!  If you use OpenMD or its source code in your
33 + * research, please cite the appropriate papers when you publish your
34 + * work.  Good starting points are:
35 + *                                                                      
36 + * [1]  Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).            
37 + * [2]  Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).          
38 + * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008).          
39 + * [4]  Vardeman & Gezelter, in progress (2009).                        
40   */
41  
42   #ifndef VISITORS_OTHERVISITOR_HPP
# Line 51 | Line 51
51   #include "selection/SelectionManager.hpp"
52   #include "selection/SelectionEvaluator.hpp"
53  
54 < namespace oopse {
54 > namespace OpenMD {
55  
56    class SimInfo;
57  
# Line 113 | Line 113 | namespace oopse {
113      
114      void writeFrame(std::ostream& outStream);    
115      void clear() {frame.clear();}
116 <    
116 >    void setPosOnly(bool posOnly){posOnly_ = posOnly;}
117    protected:
118      void internalVisit(StuntDouble* sd);
119      bool isSelected(StuntDouble* sd);
120  
121    private:  
122 +    std::string trimmedName(const std::string& atomType);
123 +
124      SimInfo* info;
125      SelectionManager seleMan;
126      SelectionEvaluator evaluator;
127      std::vector<std::string> frame;
128 <
128 >    bool posOnly_;
129    };
130  
131  
# Line 158 | Line 160 | namespace oopse {
160    };
161  
162  
163 < }//namespace oopse
163 > }//namespace OpenMD
164   #endif //_OTHERVISITOR_H_

Comparing trunk/src/visitors/OtherVisitor.hpp (property svn:keywords):
Revision 543 by tim, Thu May 26 22:45:00 2005 UTC vs.
Revision 1455 by gezelter, Thu Jun 24 20:44:18 2010 UTC

# Line 0 | Line 1
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