00001 /* 00002 LoopTK: Protein Loop Kinematic Toolkit 00003 Copyright (C) 2007 Stanford University 00004 00005 This program is free software; you can redistribute it and/or modify 00006 it under the terms of the GNU General Public License as published by 00007 the Free Software Foundation; either version 2 of the License, or 00008 (at your option) any later version. 00009 00010 This program is distributed in the hope that it will be useful, 00011 but WITHOUT ANY WARRANTY; without even the implied warranty of 00012 MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the 00013 GNU General Public License for more details. 00014 00015 You should have received a copy of the GNU General Public License along 00016 with this program; if not, write to the Free Software Foundation, Inc., 00017 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. 00018 */ 00019 00020 #ifndef __P_BOND_SHELL_H 00021 #define __P_BOND_SHELL_H 00022 00028 class PBondShell { 00029 public: 00030 00037 PBondShell() {} 00038 00045 PBondShell(const string &atomId1, const string &atomId2, bool isDOF) { 00046 m_atomId1 = atomId1; 00047 m_atomId2 = atomId2; 00048 m_isDOF = isDOF; 00049 } 00050 00055 string getAtomId1() const { return m_atomId1; } 00056 00061 string getAtomId2() const { return m_atomId2; } 00062 00068 bool isDOF() const { return m_isDOF; } 00069 00070 private: 00071 string m_atomId1; 00072 string m_atomId2; 00073 bool m_isDOF; 00074 }; 00075 00076 #endif // __P_BOND_SHELL_H