| [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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| [bcf653] | 5 | * Please see the LICENSE file or "Copyright notice" in builder.cpp for details. | 
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|  | 6 | */ | 
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|  | 7 |  | 
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| [34c338] | 8 | /* | 
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|  | 9 | * TranslateAction.cpp | 
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|  | 10 | * | 
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|  | 11 | *  Created on: May 10, 2010 | 
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|  | 12 | *      Author: heber | 
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|  | 13 | */ | 
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|  | 14 |  | 
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| [bf3817] | 15 | // include config.h | 
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|  | 16 | #ifdef HAVE_CONFIG_H | 
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|  | 17 | #include <config.h> | 
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|  | 18 | #endif | 
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|  | 19 |  | 
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| [ad011c] | 20 | #include "CodePatterns/MemDebug.hpp" | 
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| [34c338] | 21 |  | 
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| [ad011c] | 22 | #include "CodePatterns/Log.hpp" | 
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| [6f0841] | 23 | #include "Atom/atom.hpp" | 
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| [34c338] | 24 | #include "LinearAlgebra/Vector.hpp" | 
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| [ad011c] | 25 | #include "CodePatterns/Verbose.hpp" | 
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| [34c338] | 26 | #include "World.hpp" | 
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|  | 27 |  | 
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|  | 28 | #include <iostream> | 
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|  | 29 | #include <fstream> | 
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|  | 30 | #include <string> | 
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|  | 31 |  | 
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| [1fd675] | 32 | #include "Actions/AtomAction/TranslateAction.hpp" | 
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| [34c338] | 33 |  | 
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| [ce7fdc] | 34 | using namespace MoleCuilder; | 
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|  | 35 |  | 
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| [1fd675] | 36 | // and construct the stuff | 
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|  | 37 | #include "TranslateAction.def" | 
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|  | 38 | #include "Action_impl_pre.hpp" | 
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|  | 39 | /** =========== define the function ====================== */ | 
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| [34c338] | 40 | Action::state_ptr AtomTranslateAction::performCall() { | 
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| [0adac1] | 41 | Box &domain = World::getInstance().getDomain(); | 
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| [34c338] | 42 | std::vector<atom *> selectedAtoms = World::getInstance().getSelectedAtoms(); | 
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|  | 43 |  | 
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| [1fd675] | 44 | // obtain information | 
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|  | 45 | getParametersfromValueStorage(); | 
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| [34c338] | 46 |  | 
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|  | 47 | // TODO: use AtomSet::translate | 
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|  | 48 | for (std::vector<atom *>::iterator iter = selectedAtoms.begin(); iter != selectedAtoms.end(); ++iter) { | 
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| [1fd675] | 49 | *(*iter) += params.x; | 
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|  | 50 | if (params.periodic) | 
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| [712886] | 51 | (*iter)->setPosition(domain.enforceBoundaryConditions((*iter)->getPosition())); | 
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| [34c338] | 52 | } | 
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| [0adac1] | 53 |  | 
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| [1fd675] | 54 | return Action::state_ptr(new AtomTranslateState(selectedAtoms, params)); | 
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| [34c338] | 55 | } | 
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|  | 56 |  | 
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|  | 57 | Action::state_ptr AtomTranslateAction::performUndo(Action::state_ptr _state) { | 
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|  | 58 | AtomTranslateState *state = assert_cast<AtomTranslateState*>(_state.get()); | 
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| [0adac1] | 59 | Box &domain = World::getInstance().getDomain(); | 
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| [34c338] | 60 |  | 
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|  | 61 | for (std::vector<atom *>::iterator iter = state->selectedAtoms.begin(); iter != state->selectedAtoms.end(); ++iter) { | 
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| [1fd675] | 62 | *(*iter) -= state->params.x; | 
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|  | 63 | if (state->params.periodic) | 
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| [712886] | 64 | (*iter)->setPosition(domain.enforceBoundaryConditions((*iter)->getPosition())); | 
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| [34c338] | 65 | } | 
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|  | 66 |  | 
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| [0adac1] | 67 | return Action::state_ptr(_state); | 
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| [34c338] | 68 | } | 
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|  | 69 |  | 
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|  | 70 | Action::state_ptr AtomTranslateAction::performRedo(Action::state_ptr _state){ | 
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|  | 71 | AtomTranslateState *state = assert_cast<AtomTranslateState*>(_state.get()); | 
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| [0adac1] | 72 | Box &domain = World::getInstance().getDomain(); | 
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| [34c338] | 73 |  | 
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|  | 74 | for (std::vector<atom *>::iterator iter = state->selectedAtoms.begin(); iter != state->selectedAtoms.end(); ++iter) { | 
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| [1fd675] | 75 | *(*iter) += state->params.x; | 
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|  | 76 | if (state->params.periodic) | 
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| [712886] | 77 | (*iter)->setPosition(domain.enforceBoundaryConditions((*iter)->getPosition())); | 
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| [34c338] | 78 | } | 
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|  | 79 |  | 
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| [0adac1] | 80 | return Action::state_ptr(_state); | 
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| [34c338] | 81 | } | 
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|  | 82 |  | 
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|  | 83 | bool AtomTranslateAction::canUndo() { | 
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|  | 84 | return true; | 
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|  | 85 | } | 
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|  | 86 |  | 
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|  | 87 | bool AtomTranslateAction::shouldUndo() { | 
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|  | 88 | return true; | 
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|  | 89 | } | 
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| [1fd675] | 90 | /** =========== end of function ====================== */ | 
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