| 1 | /*
 | 
|---|
| 2 |  * Project: MoleCuilder
 | 
|---|
| 3 |  * Description: creates and alters molecular systems
 | 
|---|
| 4 |  * Copyright (C)  2014 Frederik Heber. All rights reserved.
 | 
|---|
| 5 |  * 
 | 
|---|
| 6 |  *
 | 
|---|
| 7 |  *   This file is part of MoleCuilder.
 | 
|---|
| 8 |  *
 | 
|---|
| 9 |  *    MoleCuilder is free software: you can redistribute it and/or modify
 | 
|---|
| 10 |  *    it under the terms of the GNU General Public License as published by
 | 
|---|
| 11 |  *    the Free Software Foundation, either version 2 of the License, or
 | 
|---|
| 12 |  *    (at your option) any later version.
 | 
|---|
| 13 |  *
 | 
|---|
| 14 |  *    MoleCuilder is distributed in the hope that it will be useful,
 | 
|---|
| 15 |  *    but WITHOUT ANY WARRANTY; without even the implied warranty of
 | 
|---|
| 16 |  *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
 | 
|---|
| 17 |  *    GNU General Public License for more details.
 | 
|---|
| 18 |  *
 | 
|---|
| 19 |  *    You should have received a copy of the GNU General Public License
 | 
|---|
| 20 |  *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>.
 | 
|---|
| 21 |  */
 | 
|---|
| 22 | 
 | 
|---|
| 23 | /*
 | 
|---|
| 24 |  * TranslateToOriginAction.cpp
 | 
|---|
| 25 |  *
 | 
|---|
| 26 |  *  Created on: Aug 14, 2014
 | 
|---|
| 27 |  *      Author: heber
 | 
|---|
| 28 |  */
 | 
|---|
| 29 | 
 | 
|---|
| 30 | // include config.h
 | 
|---|
| 31 | #ifdef HAVE_CONFIG_H
 | 
|---|
| 32 | #include <config.h>
 | 
|---|
| 33 | #endif
 | 
|---|
| 34 | 
 | 
|---|
| 35 | #include "CodePatterns/MemDebug.hpp"
 | 
|---|
| 36 | 
 | 
|---|
| 37 | #include "CodePatterns/Assert.hpp"
 | 
|---|
| 38 | #include "CodePatterns/Log.hpp"
 | 
|---|
| 39 | #include "Atom/atom.hpp"
 | 
|---|
| 40 | #include "Atom/AtomSet.hpp"
 | 
|---|
| 41 | #include "LinearAlgebra/Vector.hpp"
 | 
|---|
| 42 | #include "World.hpp"
 | 
|---|
| 43 | 
 | 
|---|
| 44 | #include <iostream>
 | 
|---|
| 45 | #include <fstream>
 | 
|---|
| 46 | #include <string>
 | 
|---|
| 47 | 
 | 
|---|
| 48 | #include "Actions/AtomAction/TranslateToOriginAction.hpp"
 | 
|---|
| 49 | 
 | 
|---|
| 50 | using namespace MoleCuilder;
 | 
|---|
| 51 | 
 | 
|---|
| 52 | // and construct the stuff
 | 
|---|
| 53 | #include "TranslateToOriginAction.def"
 | 
|---|
| 54 | #include "Action_impl_pre.hpp"
 | 
|---|
| 55 | /** =========== define the function ====================== */
 | 
|---|
| 56 | ActionState::ptr AtomTranslateToOriginAction::performCall() {
 | 
|---|
| 57 | 
 | 
|---|
| 58 |   if (World::getInstance().beginAtomSelection() == World::getInstance().endAtomSelection()) {
 | 
|---|
| 59 |     STATUS("No atoms selected.");
 | 
|---|
| 60 |     return Action::failure;
 | 
|---|
| 61 |   }
 | 
|---|
| 62 | 
 | 
|---|
| 63 |   // calculate center of selected atoms
 | 
|---|
| 64 |   Vector Translation;
 | 
|---|
| 65 |   size_t No = 0;
 | 
|---|
| 66 |   for (World::AtomSelectionIterator iter = World::getInstance().beginAtomSelection();
 | 
|---|
| 67 |       iter != World::getInstance().endAtomSelection();
 | 
|---|
| 68 |       ++iter, ++No) {
 | 
|---|
| 69 |     Translation += (iter->second)->getPosition();
 | 
|---|
| 70 |   }
 | 
|---|
| 71 |   ASSERT( No != 0, "AtomTranslateToOriginAction::performCall() - No is nonetheless zero?");
 | 
|---|
| 72 |   Translation *= -1./(double)No;
 | 
|---|
| 73 | 
 | 
|---|
| 74 |   World::AtomComposite atoms = World::getInstance().getAllAtoms();
 | 
|---|
| 75 |   atoms.translate(Translation);
 | 
|---|
| 76 |   STATUS("Atoms translated by "+toString(Translation));
 | 
|---|
| 77 | 
 | 
|---|
| 78 |   return ActionState::ptr(new AtomTranslateToOriginState(Translation, params));
 | 
|---|
| 79 | }
 | 
|---|
| 80 | 
 | 
|---|
| 81 | ActionState::ptr AtomTranslateToOriginAction::performUndo(ActionState::ptr _state) {
 | 
|---|
| 82 |   AtomTranslateToOriginState *state = assert_cast<AtomTranslateToOriginState*>(_state.get());
 | 
|---|
| 83 | 
 | 
|---|
| 84 |   World::AtomComposite atoms = World::getInstance().getAllAtoms();
 | 
|---|
| 85 |   atoms.translate(-1.*state->Translation);
 | 
|---|
| 86 |   STATUS("Undid translation by "+toString(state->Translation));
 | 
|---|
| 87 | 
 | 
|---|
| 88 |   return ActionState::ptr(_state);
 | 
|---|
| 89 | }
 | 
|---|
| 90 | 
 | 
|---|
| 91 | ActionState::ptr AtomTranslateToOriginAction::performRedo(ActionState::ptr _state){
 | 
|---|
| 92 |   AtomTranslateToOriginState *state = assert_cast<AtomTranslateToOriginState*>(_state.get());
 | 
|---|
| 93 | 
 | 
|---|
| 94 |   World::AtomComposite atoms = World::getInstance().getAllAtoms();
 | 
|---|
| 95 |   atoms.translate(state->Translation);
 | 
|---|
| 96 |   STATUS("Redid translation by "+toString(state->Translation));
 | 
|---|
| 97 | 
 | 
|---|
| 98 |   return ActionState::ptr(_state);
 | 
|---|
| 99 | }
 | 
|---|
| 100 | 
 | 
|---|
| 101 | bool AtomTranslateToOriginAction::canUndo() {
 | 
|---|
| 102 |   return true;
 | 
|---|
| 103 | }
 | 
|---|
| 104 | 
 | 
|---|
| 105 | bool AtomTranslateToOriginAction::shouldUndo() {
 | 
|---|
| 106 |   return true;
 | 
|---|
| 107 | }
 | 
|---|
| 108 | /** =========== end of function ====================== */
 | 
|---|