00001 //------------------------------------------------------------------------------ 00002 // This file is part of the OpenStructure project <www.openstructure.org> 00003 // 00004 // Copyright (C) 2008-2011 by the OpenStructure authors 00005 // 00006 // This library is free software; you can redistribute it and/or modify it under 00007 // the terms of the GNU Lesser General Public License as published by the Free 00008 // Software Foundation; either version 3.0 of the License, or (at your option) 00009 // any later version. 00010 // This library is distributed in the hope that it will be useful, but WITHOUT 00011 // ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS 00012 // FOR A PARTICULAR PURPOSE. See the GNU Lesser General Public License for more 00013 // details. 00014 // 00015 // You should have received a copy of the GNU Lesser General Public License 00016 // along with this library; if not, write to the Free Software Foundation, Inc., 00017 // 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA 00018 //------------------------------------------------------------------------------ 00019 #ifndef OST_MOL_ALG_DISTANCE_RMSD_TEST_HH 00020 #define OST_MOL_ALG_DISTANCE_RMSD_TEST_HH 00021 00022 #include <ost/mol/entity_view.hh> 00023 #include <ost/mol/alg/module_config.hh> 00024 #include <ost/mol/alg/local_dist_diff_test.hh> 00025 00026 namespace ost { namespace mol { namespace alg { 00027 00056 std::pair<Real,long int> DLLEXPORT_OST_MOL_ALG 00057 DistanceRMSDTest(const EntityView& mdl, 00058 const GlobalRDMap& glob_dist_list, 00059 Real cap_distance, int sequence_separation = 0, 00060 const String& local_drmsdt_property_string=""); 00061 00062 00071 Real DLLEXPORT_OST_MOL_ALG DRMSD(const EntityView& v, 00072 const GlobalRDMap& global_dist_list, 00073 Real cap_distance, int sequence_separation=0); 00074 00075 }}} 00076 00077 #endif 00078 00079