Line data Source code
1 : /* +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ 2 : Copyright (c) 2016-2023 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_gridtools_GridPrintingBase_h 23 : #define __PLUMED_gridtools_GridPrintingBase_h 24 : 25 : #include "core/ActionPilot.h" 26 : #include "GridVessel.h" 27 : #include "tools/OFile.h" 28 : 29 : namespace PLMD { 30 : namespace gridtools { 31 : 32 : class GridPrintingBase : public ActionPilot { 33 : protected: 34 : GridVessel* ingrid; 35 : std::string fmt, filename; 36 : bool output_for_all_replicas; 37 : std::vector<unsigned> preps; 38 : public: 39 : static void registerKeywords( Keywords& keys ); 40 : explicit GridPrintingBase(const ActionOptions&ao); 41 68 : void calculate() override {} 42 68 : void apply() override {} 43 : void update() override; 44 : void runFinalJobs() override; 45 : virtual void printGrid( OFile& ofile ) const=0; 46 : }; 47 : 48 : } 49 : } 50 : #endif