src/math/Triangle.hpp

/* Copyright (c) 2008 The University of Notre Dame. All Rights Reserved.
 *
 * The University of Notre Dame grants you ("Licensee") a
 * non-exclusive, royalty free, license to use, modify and
 * redistribute this software in source and binary code form, provided
 * that the following conditions are met:
 *
 * 1. Acknowledgement of the program authors must be made in any
 *    publication of scientific results based in part on use of the
 *    program.  An acceptable form of acknowledgement is citation of
 *    the article in which the program was described (Matthew
 *    A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher
 *    J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented
 *    Parallel Simulation Engine for Molecular Dynamics,"
 *    J. Comput. Chem. 26, pp. 252-271 (2005))
 *
 * 2. Redistributions of source code must retain the above copyright
 *    notice, this list of conditions and the following disclaimer.
 *
 * 3. Redistributions in binary form must reproduce the above copyright
 *    notice, this list of conditions and the following disclaimer in the
 *    documentation and/or other materials provided with the
 *    distribution.
 *
 * This software is provided "AS IS," without a warranty of any
 * kind. All express or implied conditions, representations and
 * warranties, including any implied warranty of merchantability,
 * fitness for a particular purpose or non-infringement, are hereby
 * excluded.  The University of Notre Dame and its licensors shall not
 * be liable for any damages suffered by licensee as a result of
 * using, modifying or distributing the software or its
 * derivatives. In no event will the University of Notre Dame or its
 * licensors be liable for any lost revenue, profit or data, or for
 * direct, indirect, special, consequential, incidental or punitive
 * damages, however caused and regardless of the theory of liability,
 * arising out of the use of or inability to use software, even if the
 * University of Notre Dame has been advised of the possibility of
 * such damages.
 *
 *
 *  Triangle.hpp
 *
 *  Purpose: Provide facets from hull to oopse
 *
 *  Created by Charles F. Vardeman II on 29 July 2008.
 *  @author  Charles F. Vardeman II
 *  @version $Id: Triangle.hpp,v 1.1 2008-09-14 01:32:25 chuckv Exp $
 *
 */


#ifndef MATH_FACET_HPP
#define MATH_FACET_HPP

#include "math/Vector3.hpp"
#include "config.h"
#include "primitives/StuntDouble.hpp"

#include <vector>


namespace oopse {

/**
   * @class Triangle
   *
   * Triangle provides geometric data to oopse. Triangle includes
   * information about the normal, centroid and the atoms
   * that belong to this triangle.
   */
  class Triangle {

  public:
    Triangle(){};
    virtual ~Triangle() { };

    void setNormal(Vector3d normal) {
      normal_ = normal;
    }

    void addVertex(StuntDouble* thisSD){
      vertexSD_.push_back(thisSD);
    }
    
    std::vector<StuntDouble*> getVertices(){return vertexSD_;}

    void setArea(RealType area) {
      area_ = area;
    }
    
    Vector3d getNormal() { 
      return normal_;
    }
    
    RealType getArea() { 
      return area_;
    }

    void setCentroid(Vector3d centroid) { 
      centroid_ = centroid;
    }

    Vector3d getCentroid() { 
      return centroid_;
    }

  private:
    /* Local Indentity of vertex atoms in pos array*/
    std::vector <StuntDouble*> vertexSD_;
    Vector3d normal_;
    Vector3d centroid_;
    RealType area_;
    
  }; // End class Triangle
    
    
} //End Namespace oopse


#endif // MATH_FACET_HPP


Revision:	1293
Committed:	Sun Sep 14 01:32:26 2008 UTC (16 years, 7 months ago) by chuckv
File size:	3570 byte(s)
Log Message:	Added large quantities of code for convex hull and constant pressure langevin dynamics.
#	Content
1	/* Copyright (c) 2008 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
18	* notice, this list of conditions and the following disclaimer.
19	*
20	* 3. Redistributions in binary form must reproduce the above copyright
21	* notice, this list of conditions and the following disclaimer in the
22	* documentation and/or other materials provided with the
23	* distribution.
24	*
25	* This software is provided "AS IS," without a warranty of any
26	* kind. All express or implied conditions, representations and
27	* warranties, including any implied warranty of merchantability,
28	* fitness for a particular purpose or non-infringement, are hereby
29	* excluded. The University of Notre Dame and its licensors shall not
30	* be liable for any damages suffered by licensee as a result of
31	* using, modifying or distributing the software or its
32	* derivatives. In no event will the University of Notre Dame or its
33	* licensors be liable for any lost revenue, profit or data, or for
34	* direct, indirect, special, consequential, incidental or punitive
35	* damages, however caused and regardless of the theory of liability,
36	* arising out of the use of or inability to use software, even if the
37	* University of Notre Dame has been advised of the possibility of
38	* such damages.
39	*
40	*
41	* Triangle.hpp
42	*
43	* Purpose: Provide facets from hull to oopse
44	*
45	* Created by Charles F. Vardeman II on 29 July 2008.
46	* @author Charles F. Vardeman II
47	* @version $Id: Triangle.hpp,v 1.1 2008-09-14 01:32:25 chuckv Exp $
48	*
49	*/
50
51
52	#ifndef MATH_FACET_HPP
53	#define MATH_FACET_HPP
54
55	#include "math/Vector3.hpp"
56	#include "config.h"
57	#include "primitives/StuntDouble.hpp"
58
59	#include <vector>
60
61
62	namespace oopse {
63
64	/**
65	* @class Triangle
66	*
67	* Triangle provides geometric data to oopse. Triangle includes
68	* information about the normal, centroid and the atoms
69	* that belong to this triangle.
70	*/
71	class Triangle {
72
73	public:
74	Triangle(){};
75	virtual ~Triangle() { };
76
77	void setNormal(Vector3d normal) {
78	normal_ = normal;
79	}
80
81	void addVertex(StuntDouble* thisSD){
82	vertexSD_.push_back(thisSD);
83	}
84
85	std::vector<StuntDouble*> getVertices(){return vertexSD_;}
86
87	void setArea(RealType area) {
88	area_ = area;
89	}
90
91	Vector3d getNormal() {
92	return normal_;
93	}
94
95	RealType getArea() {
96	return area_;
97	}
98
99	void setCentroid(Vector3d centroid) {
100	centroid_ = centroid;
101	}
102
103	Vector3d getCentroid() {
104	return centroid_;
105	}
106
107	private:
108	/* Local Indentity of vertex atoms in pos array*/
109	std::vector <StuntDouble*> vertexSD_;
110	Vector3d normal_;
111	Vector3d centroid_;
112	RealType area_;
113
114	}; // End class Triangle
115
116
117
118	} //End Namespace oopse
119
120
121
122	#endif // MATH_FACET_HPP
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