| [c7fe90] | 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)  2014 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 | * TranslateToOriginAction.cpp | 
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|  | 25 | * | 
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|  | 26 | *  Created on: Aug 14, 2014 | 
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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 "CodePatterns/Assert.hpp" | 
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|  | 38 | #include "CodePatterns/Log.hpp" | 
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|  | 39 | #include "Atom/atom.hpp" | 
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|  | 40 | #include "Atom/AtomSet.hpp" | 
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|  | 41 | #include "LinearAlgebra/Vector.hpp" | 
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|  | 42 | #include "World.hpp" | 
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|  | 43 |  | 
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|  | 44 | #include <iostream> | 
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|  | 45 | #include <fstream> | 
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|  | 46 | #include <string> | 
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|  | 47 |  | 
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|  | 48 | #include "Actions/AtomAction/TranslateToOriginAction.hpp" | 
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|  | 49 |  | 
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|  | 50 | using namespace MoleCuilder; | 
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|  | 51 |  | 
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|  | 52 | // and construct the stuff | 
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|  | 53 | #include "TranslateToOriginAction.def" | 
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|  | 54 | #include "Action_impl_pre.hpp" | 
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|  | 55 | /** =========== define the function ====================== */ | 
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|  | 56 | ActionState::ptr AtomTranslateToOriginAction::performCall() { | 
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|  | 57 |  | 
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|  | 58 | if (World::getInstance().beginAtomSelection() == World::getInstance().endAtomSelection()) { | 
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|  | 59 | STATUS("No atoms selected."); | 
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|  | 60 | return Action::failure; | 
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|  | 61 | } | 
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|  | 62 |  | 
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|  | 63 | // calculate center of selected atoms | 
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|  | 64 | Vector Translation; | 
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|  | 65 | size_t No = 0; | 
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|  | 66 | for (World::AtomSelectionIterator iter = World::getInstance().beginAtomSelection(); | 
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|  | 67 | iter != World::getInstance().endAtomSelection(); | 
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|  | 68 | ++iter, ++No) { | 
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|  | 69 | Translation += (iter->second)->getPosition(); | 
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|  | 70 | } | 
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|  | 71 | ASSERT( No != 0, "AtomTranslateToOriginAction::performCall() - No is nonetheless zero?"); | 
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|  | 72 | Translation *= -1./(double)No; | 
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|  | 73 |  | 
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|  | 74 | World::AtomComposite atoms = World::getInstance().getAllAtoms(); | 
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|  | 75 | atoms.translate(Translation); | 
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|  | 76 | STATUS("Atoms translated by "+toString(Translation)); | 
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|  | 77 |  | 
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|  | 78 | return ActionState::ptr(new AtomTranslateToOriginState(Translation, params)); | 
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|  | 79 | } | 
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|  | 80 |  | 
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|  | 81 | ActionState::ptr AtomTranslateToOriginAction::performUndo(ActionState::ptr _state) { | 
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|  | 82 | AtomTranslateToOriginState *state = assert_cast<AtomTranslateToOriginState*>(_state.get()); | 
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|  | 83 |  | 
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|  | 84 | World::AtomComposite atoms = World::getInstance().getAllAtoms(); | 
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|  | 85 | atoms.translate(-1.*state->Translation); | 
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|  | 86 | STATUS("Undid translation by "+toString(state->Translation)); | 
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|  | 87 |  | 
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|  | 88 | return ActionState::ptr(_state); | 
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|  | 89 | } | 
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|  | 90 |  | 
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|  | 91 | ActionState::ptr AtomTranslateToOriginAction::performRedo(ActionState::ptr _state){ | 
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|  | 92 | AtomTranslateToOriginState *state = assert_cast<AtomTranslateToOriginState*>(_state.get()); | 
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|  | 93 |  | 
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|  | 94 | World::AtomComposite atoms = World::getInstance().getAllAtoms(); | 
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|  | 95 | atoms.translate(state->Translation); | 
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|  | 96 | STATUS("Redid translation by "+toString(state->Translation)); | 
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|  | 97 |  | 
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|  | 98 | return ActionState::ptr(_state); | 
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|  | 99 | } | 
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|  | 100 |  | 
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|  | 101 | bool AtomTranslateToOriginAction::canUndo() { | 
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|  | 102 | return true; | 
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|  | 103 | } | 
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|  | 104 |  | 
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|  | 105 | bool AtomTranslateToOriginAction::shouldUndo() { | 
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|  | 106 | return true; | 
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|  | 107 | } | 
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|  | 108 | /** =========== end of function ====================== */ | 
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