00001 /************************************************************************************************** 00002 ***** Copyright (C) 2005 John Schneiderman <JohnMS@member.fsf.org> ***** 00003 ***** ***** 00004 ***** This program is free software; you can redistribute it and/or modify ***** 00005 ***** it under the terms of the GNU General Public License as published by ***** 00006 ***** the Free Software Foundation; either version 2 of the License, or ***** 00007 ***** (at your option) any later version. ***** 00008 ***** ***** 00009 ***** This program is distributed in the hope that it will be useful, ***** 00010 ***** but WITHOUT ANY WARRANTY; without even the implied warranty of ***** 00011 ***** MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the ***** 00012 ***** GNU General Public License for more details. ***** 00013 ***** ***** 00014 ***** You should have received a copy of the GNU General Public License ***** 00015 ***** along with this program; if not, write to the Free Software ***** 00016 ***** Foundation, Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA ***** 00017 ***************************************************************************************************/ 00018 #ifndef _ATOM_H_ 00019 #define _ATOM_H_ 00020 00021 #include "coordinate.h" 00022 00028 class Atom 00029 { 00030 public: 00034 struct atom_t 00035 { 00037 Coordinate position; 00039 Coordinate velocity; 00041 Coordinate acceleration; 00043 double potentialEnergy; 00045 double kineticEnergy; 00046 }; 00050 atom_t properties; 00051 00055 Atom(); 00060 Atom(const Atom &atom); 00066 Atom& operator=(const Atom &rhs); 00073 bool operator==(const Atom &rhs) const; 00080 bool operator!=(const Atom &rhs) const; 00081 }; 00082 #endif