| 1 | /* | 
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| 2 | * Project: MoleCuilder | 
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| 3 | * Description: creates and alters molecular systems | 
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| 4 | * Copyright (C)  2016 Frederik Heber. All rights reserved. | 
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| 5 | * | 
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| 6 | * | 
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| 7 | *   This file is part of MoleCuilder. | 
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| 8 | * | 
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| 9 | *    MoleCuilder is free software: you can redistribute it and/or modify | 
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| 10 | *    it under the terms of the GNU General Public License as published by | 
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| 11 | *    the Free Software Foundation, either version 2 of the License, or | 
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| 12 | *    (at your option) any later version. | 
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| 13 | * | 
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| 14 | *    MoleCuilder is distributed in the hope that it will be useful, | 
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| 15 | *    but WITHOUT ANY WARRANTY; without even the implied warranty of | 
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| 16 | *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the | 
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| 17 | *    GNU General Public License for more details. | 
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| 18 | * | 
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| 19 | *    You should have received a copy of the GNU General Public License | 
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| 20 | *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>. | 
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| 21 | */ | 
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| 22 |  | 
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| 23 | /* | 
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| 24 | * SaveAtomFragmentsAction.cpp | 
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| 25 | * | 
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| 26 | *  Created on: Mar 07, 2016 | 
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| 27 | *      Author: heber | 
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| 28 | */ | 
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| 29 |  | 
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| 30 | // include config.h | 
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| 31 | #ifdef HAVE_CONFIG_H | 
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| 32 | #include <config.h> | 
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| 33 | #endif | 
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| 34 |  | 
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| 35 | // include headers that implement a archive in simple text format | 
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| 36 | // and before MemDebug due to placement new | 
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| 37 | #include <boost/archive/text_oarchive.hpp> | 
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| 38 | #include <boost/archive/text_iarchive.hpp> | 
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| 39 |  | 
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| 40 | #include "CodePatterns/MemDebug.hpp" | 
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| 41 |  | 
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| 42 | #include <iostream> | 
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| 43 |  | 
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| 44 | #include "CodePatterns/Log.hpp" | 
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| 45 |  | 
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| 46 | #include "Fragmentation/Homology/AtomFragmentsMap.hpp" | 
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| 47 | #include "Fragmentation/KeySet.hpp" | 
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| 48 |  | 
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| 49 | #include "Actions/PotentialAction/SaveAtomFragmentsAction.hpp" | 
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| 50 |  | 
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| 51 | using namespace MoleCuilder; | 
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| 52 |  | 
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| 53 | // and construct the stuff | 
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| 54 | #include "SaveAtomFragmentsAction.def" | 
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| 55 | #include "Action_impl_pre.hpp" | 
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| 56 | /** =========== define the function ====================== */ | 
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| 57 |  | 
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| 58 | bool writeAtomFragmentsToFile( | 
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| 59 | const boost::filesystem::path &atomfragments_file | 
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| 60 | ) | 
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| 61 | { | 
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| 62 | /// store homology container again | 
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| 63 | AtomFragmentsMap &atomfragments_container = AtomFragmentsMap::getInstance(); | 
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| 64 | std::ofstream outputstream(atomfragments_file.string().c_str()); | 
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| 65 | if (outputstream.good()) { // check if opened | 
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| 66 | boost::archive::text_oarchive oa(outputstream); | 
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| 67 | oa << atomfragments_container; | 
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| 68 | if (outputstream.fail()) { // check if correctly written | 
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| 69 | LOG(1, "Failed to write to file " << atomfragments_file.string() << "."); | 
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| 70 | return false; | 
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| 71 | } else | 
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| 72 | outputstream.close(); | 
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| 73 | } else { | 
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| 74 | LOG(1, "Failed to open file " << atomfragments_file.string() | 
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| 75 | << " for writing."); | 
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| 76 | return false; | 
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| 77 | } | 
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| 78 | return true; | 
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| 79 | } | 
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| 80 |  | 
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| 81 | ActionState::ptr PotentialSaveAtomFragmentsAction::performCall() | 
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| 82 | { | 
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| 83 | if (!params.atomfragments_file.get().empty()) { | 
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| 84 | const boost::filesystem::path &atomfragments_file = params.atomfragments_file.get(); | 
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| 85 | LOG(1, "INFO: Appending AtomFragment associations to file " << atomfragments_file.string() << "."); | 
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| 86 | if (!writeAtomFragmentsToFile(atomfragments_file)) { | 
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| 87 | STATUS("Failed to write atomfragments file."); | 
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| 88 | return Action::failure; | 
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| 89 | } | 
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| 90 | return Action::success; | 
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| 91 | } else { | 
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| 92 | STATUS("Homology file name empty."); | 
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| 93 | return Action::failure; | 
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| 94 | } | 
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| 95 | } | 
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| 96 |  | 
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| 97 | ActionState::ptr PotentialSaveAtomFragmentsAction::performUndo(ActionState::ptr _state) { | 
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| 98 | return Action::success; | 
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| 99 | } | 
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| 100 |  | 
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| 101 | ActionState::ptr PotentialSaveAtomFragmentsAction::performRedo(ActionState::ptr _state){ | 
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| 102 | return Action::success; | 
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| 103 | } | 
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| 104 |  | 
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| 105 | bool PotentialSaveAtomFragmentsAction::canUndo() { | 
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| 106 | return false; | 
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| 107 | } | 
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| 108 |  | 
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| 109 | bool PotentialSaveAtomFragmentsAction::shouldUndo() { | 
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| 110 | return false; | 
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| 111 | } | 
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| 112 | /** =========== end of function ====================== */ | 
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