| 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 ====================== */
|
|---|