ViewVC Help
View File | Revision Log | Show Annotations | View Changeset | Root Listing
root/OpenMD/branches/development/src/math/Hull.hpp
(Generate patch)

Comparing:
trunk/src/math/Hull.hpp (file contents), Revision 1293 by chuckv, Sun Sep 14 01:32:26 2008 UTC vs.
branches/development/src/math/Hull.hpp (file contents), Revision 1465 by chuckv, Fri Jul 9 23:08:25 2010 UTC

# Line 1 | Line 1
1 < /* Copyright (c) 2008 The University of Notre Dame. All Rights Reserved.
1 > /* Copyright (c) 2008, 2009 The University of Notre Dame. All Rights Reserved.
2   *
3   * The University of Notre Dame grants you ("Licensee") a
4   * non-exclusive, royalty free, license to use, modify and
5   * redistribute this software in source and binary code form, provided
6   * that the following conditions are met:
7   *
8 < * 1. Acknowledgement of the program authors must be made in any
9 < *    publication of scientific results based in part on use of the
10 < *    program.  An acceptable form of acknowledgement is citation of
11 < *    the article in which the program was described (Matthew
12 < *    A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher
13 < *    J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented
14 < *    Parallel Simulation Engine for Molecular Dynamics,"
15 < *    J. Comput. Chem. 26, pp. 252-271 (2005))
16 < *
17 < * 2. Redistributions of source code must retain the above copyright
8 > * 1. Redistributions of source code must retain the above copyright
9   *    notice, this list of conditions and the following disclaimer.
10   *
11 < * 3. Redistributions in binary form must reproduce the above copyright
11 > * 2. Redistributions in binary form must reproduce the above copyright
12   *    notice, this list of conditions and the following disclaimer in the
13   *    documentation and/or other materials provided with the
14   *    distribution.
# Line 37 | Line 28
28   * University of Notre Dame has been advised of the possibility of
29   * such damages.
30   *
31 + * SUPPORT OPEN SCIENCE!  If you use OpenMD or its source code in your
32 + * research, please cite the appropriate papers when you publish your
33 + * work.  Good starting points are:
34 + *                                                                      
35 + * [1]  Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).            
36 + * [2]  Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).          
37 + * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008).          
38 + * [4]  Vardeman & Gezelter, in progress (2009).                        
39   *
40 + *
41   *  Hull.hpp
42   *
43 < *  Purpose: Provide common interface for computing hulls in oopse.
43 > *  Purpose: Provide common interface for computing hulls in OpenMD.
44   *
45   *  Created by Charles F. Vardeman II on 27 July 2008.
46   *  @author  Charles F. Vardeman II
47 < *  @version $Id: Hull.hpp,v 1.1 2008-09-14 01:32:25 chuckv Exp $
47 > *  @version $Id$
48   *
49   */
50  
# Line 62 | Line 62
62  
63  
64  
65 < namespace oopse {
65 > namespace OpenMD {
66    class Hull {
67    public:
68      virtual ~Hull(){};
69      virtual void computeHull(std::vector<StuntDouble*> bodydoubles)=0;
70      virtual RealType getArea()=0; //Total area of Hull
71 –    virtual int getNs()=0;  //Number of Surface Atoms
71      virtual RealType getVolume()=0; //Total Volume inclosed by Hull
72 <    virtual std::vector< StuntDouble* > getSurfaceAtoms()=0; //Returns a list of surface atoms
74 <    virtual std::vector<Triangle* > getMesh()=0;
72 >    virtual std::vector<Triangle > getMesh()=0;
73      virtual void printHull(const std::string& geomFileName)=0;
74    };
75   }

Comparing:
trunk/src/math/Hull.hpp (property svn:keywords), Revision 1293 by chuckv, Sun Sep 14 01:32:26 2008 UTC vs.
branches/development/src/math/Hull.hpp (property svn:keywords), Revision 1465 by chuckv, Fri Jul 9 23:08:25 2010 UTC

# Line 0 | Line 1
1 + Author Id Revision Date

Diff Legend

– Removed lines
+ Added lines
< Changed lines
> Changed lines