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1 : /* +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 2 : Copyright (c) 2011-2023 The plumed team 3 : (see the PEOPLE file at the root of the distribution for a list of names) 4 : 5 : See http://www.plumed.org for more information. 6 : 7 : This file is part of plumed, version 2. 8 : 9 : plumed is free software: you can redistribute it and/or modify 10 : it under the terms of the GNU Lesser General Public License as published by 11 : the Free Software Foundation, either version 3 of the License, or 12 : (at your option) any later version. 13 : 14 : plumed is distributed in the hope that it will be useful, 15 : but WITHOUT ANY WARRANTY; without even the implied warranty of 16 : MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the 17 : GNU Lesser General Public License for more details. 18 : 19 : You should have received a copy of the GNU Lesser General Public License 20 : along with plumed. If not, see <http://www.gnu.org/licenses/>. 21 : +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ */ 22 : #ifndef __PLUMED_function_Sum_h 23 : #define __PLUMED_function_Sum_h 24 : 25 : #include "FunctionTemplateBase.h" 26 : 27 : namespace PLMD { 28 : namespace function { 29 : 30 5020 : class Sum : public FunctionTemplateBase { 31 : private: 32 : double prefactor; 33 : public: 34 : void registerKeywords( Keywords& keys ) override; 35 : void read( ActionWithArguments* action ) override; 36 : bool zeroRank() const override; 37 : void setPrefactor( ActionWithArguments* action, const double pref ) override; 38 : void calc( const ActionWithArguments* action, const std::vector<double>& args, std::vector<double>& vals, Matrix<double>& derivatives ) const override; 39 : }; 40 : 41 : } 42 : } 43 : #endif