| 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)  2012 University of Bonn. 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 | * BondRemoveAction.cpp | 
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| 25 | * | 
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| 26 | *  Created on: Nov 14, 2012 | 
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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 "CodePatterns/MemDebug.hpp" | 
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| 36 |  | 
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| 37 | #include "Atom/atom.hpp" | 
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| 38 | #include "Bond/bond.hpp" | 
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| 39 | #include "CodePatterns/Assert.hpp" | 
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| 40 | #include "CodePatterns/Log.hpp" | 
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| 41 | #include "CodePatterns/Verbose.hpp" | 
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| 42 | #include "Descriptors/AtomIdDescriptor.hpp" | 
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| 43 | #include "World.hpp" | 
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| 44 | #include "WorldTime.hpp" | 
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| 45 |  | 
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| 46 | #include <iostream> | 
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| 47 | #include <string> | 
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| 48 |  | 
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| 49 | #include "Actions/BondAction/BondRemoveAction.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 "BondRemoveAction.def" | 
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| 55 | #include "Action_impl_pre.hpp" | 
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| 56 | /** =========== define the function ====================== */ | 
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| 57 | Action::state_ptr BondRemoveAction::performCall() { | 
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| 58 | // check preconditions | 
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| 59 | if (World::getInstance().countSelectedAtoms() != 2) { | 
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| 60 | ELOG(1, "Exactly two atoms must be selected for BondAction Remove."); | 
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| 61 | return Action::failure; | 
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| 62 | } | 
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| 63 | const std::vector<atom *> selected_atoms = World::getInstance().getSelectedAtoms(); | 
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| 64 | if (!selected_atoms[0]->IsBondedTo(WorldTime::getTime(), selected_atoms[1])) { | 
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| 65 | ELOG(2, "There is no bond in between the two selected atoms."); | 
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| 66 | return Action::failure; | 
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| 67 | } | 
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| 68 |  | 
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| 69 | // create undo | 
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| 70 | BondRemoveState *UndoState = new BondRemoveState(selected_atoms[0]->getId(), selected_atoms[1]->getId(), params); | 
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| 71 |  | 
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| 72 | // execute action | 
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| 73 | selected_atoms[0]->removeBond(WorldTime::getTime(), selected_atoms[1]); | 
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| 74 | ASSERT( !selected_atoms[0]->IsBondedTo(WorldTime::getTime(), selected_atoms[1]), | 
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| 75 | "BondRemoveAction::performCall() - removing bond in between " | 
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| 76 | +toString(*selected_atoms[0])+" and "+toString(*selected_atoms[1])+" failed."); | 
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| 77 |  | 
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| 78 | return Action::state_ptr(UndoState); | 
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| 79 | } | 
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| 80 |  | 
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| 81 | Action::state_ptr BondRemoveAction::performUndo(Action::state_ptr _state) { | 
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| 82 | BondRemoveState *state = assert_cast<BondRemoveState*>(_state.get()); | 
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| 83 |  | 
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| 84 | // check whether bond already existed | 
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| 85 | atom * const first = World::getInstance().getAtom(AtomById(state->firstId)); | 
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| 86 | atom * const second = World::getInstance().getAtom(AtomById(state->secondId)); | 
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| 87 | ASSERT((first != NULL) && (second != NULL), | 
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| 88 | "BondRemoveAction::performUndo() - at least one of the ids " | 
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| 89 | +toString(state->firstId)+" or "+toString(state->secondId)+" is not present."); | 
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| 90 | if (!first->IsBondedTo(WorldTime::getTime(), second)) { | 
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| 91 | first->addBond(WorldTime::getTime(), second); | 
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| 92 | } else { | 
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| 93 | ELOG(2, "There is already a bond in between "+toString(state->firstId) | 
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| 94 | +" and "+toString(state->secondId)+"."); | 
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| 95 | } | 
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| 96 |  | 
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| 97 | return Action::state_ptr(_state); | 
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| 98 | } | 
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| 99 |  | 
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| 100 | Action::state_ptr BondRemoveAction::performRedo(Action::state_ptr _state){ | 
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| 101 | BondRemoveState *state = assert_cast<BondRemoveState*>(_state.get()); | 
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| 102 |  | 
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| 103 | // check whether bond already existed | 
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| 104 | atom * const first = World::getInstance().getAtom(AtomById(state->firstId)); | 
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| 105 | atom * const second = World::getInstance().getAtom(AtomById(state->secondId)); | 
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| 106 | ASSERT((first != NULL) && (second != NULL), | 
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| 107 | "BondRemoveAction::performRedo() - at least one of the ids " | 
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| 108 | +toString(state->firstId)+" or "+toString(state->secondId)+" is not present."); | 
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| 109 | if (first->IsBondedTo(WorldTime::getTime(), second)) { | 
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| 110 | first->removeBond(WorldTime::getTime(), second); | 
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| 111 | } else { | 
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| 112 | ELOG(2, "There is no bond in between "+toString(state->firstId) | 
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| 113 | +" and "+toString(state->secondId)+"."); | 
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| 114 | } | 
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| 115 |  | 
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| 116 | return Action::state_ptr(_state); | 
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| 117 | } | 
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| 118 |  | 
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| 119 | bool BondRemoveAction::canUndo() { | 
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| 120 | return true; | 
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| 121 | } | 
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| 122 |  | 
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| 123 | bool BondRemoveAction::shouldUndo() { | 
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| 124 | return true; | 
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| 125 | } | 
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| 126 | /** =========== end of function ====================== */ | 
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