00001 // -*- mode: c++; -*- 00002 // 00003 //The Biomolecule Toolkit (BTK) is a C++ library for use in the 00004 //modeling, analysis, and design of biological macromolecules. 00005 //Copyright (C) 2004, Christopher Saunders <ctsa@users.sourceforge.net> 00006 // 00007 //This program is free software; you can redistribute it and/or modify 00008 //it under the terms of the GNU Lesser General Public License as published 00009 //by the Free Software Foundation; either version 2.1 of the License, or (at 00010 //your option) any later version. 00011 // 00012 //This program is distributed in the hope that it will be useful, but 00013 //WITHOUT ANY WARRANTY; without even the implied warranty of 00014 //MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU 00015 //Lesser General Public License for more details. 00016 // 00017 //You should have received a copy of the GNU Lesser General Public License 00018 //along with this program; if not, write to the Free Software Foundation, 00019 //Inc., 59 Temple Place - Suite 330, Boston, MA 02111-1307, USA. 00020 00021 00025 00026 00027 #ifndef BTK_ATOM_GROUP_CONCEPT_H 00028 #define BTK_ATOM_GROUP_CONCEPT_H 00029 00030 00031 #include "group_types.h" 00032 #include "group_variant_types.h" 00033 00034 #include <set> 00035 #include <string> 00036 00037 namespace BTK { 00038 00042 struct AtomGroupConcept { 00045 typedef std::set<GROUP_VARIANT::index_t> group_variant_container_t; 00046 00047 virtual GROUP::index_t group_index() const = 0; 00048 virtual const group_variant_container_t& group_variant_codes() const = 0; 00049 virtual const std::string& group_name3() const = 0; 00050 virtual int group_num() const = 0; 00051 }; 00052 00053 } 00054 00055 00056 #endif
1.3.6