[bcf653] | 1 | /*
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| 2 | * Project: MoleCuilder
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| 3 | * Description: creates and alters molecular systems
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[0aa122] | 4 | * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
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[94d5ac6] | 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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[bcf653] | 21 | */
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| 22 |
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[97ebf8] | 23 | /*
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| 24 | * ChangeElementAction.cpp
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| 25 | *
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| 26 | * Created on: May 9, 2010
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| 27 | * Author: heber
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| 28 | */
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| 29 |
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[bf3817] | 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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[ad011c] | 35 | #include "CodePatterns/MemDebug.hpp"
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[112b09] | 36 |
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[f8456c] | 37 | #include "Descriptors/AtomIdDescriptor.hpp"
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[6f0841] | 38 | #include "Atom/atom.hpp"
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[3bdb6d] | 39 | #include "Element/element.hpp"
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[ad011c] | 40 | #include "CodePatterns/Log.hpp"
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[57f243] | 41 | #include "LinearAlgebra/Vector.hpp"
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[ad011c] | 42 | #include "CodePatterns/Verbose.hpp"
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[dddbfe] | 43 | #include "molecule.hpp"
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[97ebf8] | 44 | #include "World.hpp"
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| 45 |
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| 46 | #include <iostream>
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[f8456c] | 47 | #include <map>
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[97ebf8] | 48 | #include <string>
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| 49 |
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[1fd675] | 50 | #include "Actions/AtomAction/ChangeElementAction.hpp"
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[454065] | 51 |
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[ce7fdc] | 52 | using namespace MoleCuilder;
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| 53 |
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[1fd675] | 54 | // and construct the stuff
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| 55 | #include "ChangeElementAction.def"
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| 56 | #include "Action_impl_pre.hpp"
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| 57 | /** =========== define the function ====================== */
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[b5b01e] | 58 | ActionState::ptr AtomChangeElementAction::performCall() {
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[f8456c] | 59 | // create undo state
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| 60 | ElementMap Elements;
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| 61 | for (World::AtomSelectionIterator iter = World::getInstance().beginAtomSelection(); iter != World::getInstance().endAtomSelection(); ++iter) {
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| 62 | Elements.insert(std::pair<int, const element *> (iter->second->getId(), iter->second->getType()));
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| 63 | }
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[1fd675] | 64 | AtomChangeElementState *UndoState = new AtomChangeElementState(Elements, params);
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[f8456c] | 65 |
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[454065] | 66 | for (World::AtomSelectionIterator iter = World::getInstance().beginAtomSelection(); iter != World::getInstance().endAtomSelection(); ++iter) {
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[f01769] | 67 | atom *first = iter->second;
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[f10b0c] | 68 | LOG(1, "Changing atom " << *first << " to element " << *params.elemental.get() << ".");
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| 69 | first->setType(params.elemental.get());
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[454065] | 70 | }
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[b5b01e] | 71 | return ActionState::ptr(UndoState);
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[97ebf8] | 72 | }
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| 73 |
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[b5b01e] | 74 | ActionState::ptr AtomChangeElementAction::performUndo(ActionState::ptr _state) {
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[f8456c] | 75 | AtomChangeElementState *state = assert_cast<AtomChangeElementState*>(_state.get());
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| 76 | for(ElementMap::const_iterator iter = state->Elements.begin(); iter != state->Elements.end(); ++iter) {
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[f01769] | 77 | atom *first = World::getInstance().getAtom(AtomById(iter->first));
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[f8456c] | 78 | first->setType(iter->second);
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| 79 | }
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| 80 |
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[b5b01e] | 81 | return ActionState::ptr(_state);
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[97ebf8] | 82 | }
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| 83 |
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[b5b01e] | 84 | ActionState::ptr AtomChangeElementAction::performRedo(ActionState::ptr _state){
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[f8456c] | 85 | AtomChangeElementState *state = assert_cast<AtomChangeElementState*>(_state.get());
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| 86 |
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| 87 | for(ElementMap::const_iterator iter = state->Elements.begin(); iter != state->Elements.end(); ++iter) {
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[f01769] | 88 | atom *first = World::getInstance().getAtom(AtomById(iter->first));
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[f10b0c] | 89 | first->setType(state->params.elemental.get());
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[f8456c] | 90 | }
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| 91 |
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[b5b01e] | 92 | return ActionState::ptr(_state);
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[97ebf8] | 93 | }
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| 94 |
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| 95 | bool AtomChangeElementAction::canUndo() {
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[f8456c] | 96 | return true;
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[97ebf8] | 97 | }
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| 98 |
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| 99 | bool AtomChangeElementAction::shouldUndo() {
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[f8456c] | 100 | return true;
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[97ebf8] | 101 | }
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[1fd675] | 102 | /** =========== end of function ====================== */
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