source: src/Actions/AtomAction/RotateAroundOriginByAngleAction.cpp@ a844d8

Candidate_v1.6.1
Last change on this file since a844d8 was 9eb71b3, checked in by Frederik Heber <frederik.heber@…>, 8 years ago

Commented out MemDebug include and Memory::ignore.

  • MemDebug clashes with various allocation operators that use a specific placement in memory. It is so far not possible to wrap new/delete fully. Hence, we stop this effort which so far has forced us to put ever more includes (with clashes) into MemDebug and thereby bloat compilation time.
  • MemDebug does not add that much usefulness which is not also provided by valgrind.
  • Property mode set to 100644
File size: 3.9 KB
RevLine 
[bcf653]1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
[0aa122]4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
[94d5ac6]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/>.
[bcf653]21 */
22
[22c44bf]23/*
24 * RotateAroundOriginByAngleAction.cpp
25 *
26 * Created on: Aug 06, 2010
27 * Author: heber
28 */
29
[bf3817]30// include config.h
31#ifdef HAVE_CONFIG_H
32#include <config.h>
33#endif
34
[9eb71b3]35//#include "CodePatterns/MemDebug.hpp"
[22c44bf]36
[ad011c]37#include "CodePatterns/Log.hpp"
38#include "CodePatterns/Verbose.hpp"
[22c44bf]39#include "LinearAlgebra/Line.hpp"
40#include "LinearAlgebra/Vector.hpp"
41#include "molecule.hpp"
42
43
[146cff2]44#include <cmath>
[22c44bf]45#include <iostream>
46#include <fstream>
47#include <string>
48
[1fd675]49#include "Actions/AtomAction/RotateAroundOriginByAngleAction.hpp"
[22c44bf]50
[ce7fdc]51using namespace MoleCuilder;
52
[1fd675]53// and construct the stuff
54#include "RotateAroundOriginByAngleAction.def"
55#include "Action_impl_pre.hpp"
56/** =========== define the function ====================== */
[b5b01e]57ActionState::ptr AtomRotateAroundOriginByAngleAction::performCall() {
[22c44bf]58 std::vector<atom *> selectedAtoms = World::getInstance().getSelectedAtoms();
59
60 // check whether Axis is valid
[26b4d62]61 if (params.Axis.get().IsZero()) {
62 STATUS("Specified Rotation axis is zero.");
[22c44bf]63 return Action::failure;
[26b4d62]64 }
[22c44bf]65
66 // convert from degrees to radian
[d555b8]67 double radian = params.angle.get() * M_PI/180.;
[22c44bf]68
69 // Creation Line that is the rotation axis
[f10b0c]70 Line RotationAxis(Vector(0.,0.,0.), params.Axis.get());
[22c44bf]71
[d555b8]72 LOG(0, "Rotate around origin by " << radian << " radian, axis from origin to " << params.Axis.get() << ".");
[22c44bf]73 // TODO: use AtomSet::rotate?
74 for (std::vector<atom *>::iterator iter = selectedAtoms.begin(); iter != selectedAtoms.end(); ++iter) {
[d555b8]75 (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), radian));
[22c44bf]76 }
[47d041]77 LOG(0, "done.");
[99db9b]78 return ActionState::ptr(new AtomRotateAroundOriginByAngleState(selectedAtoms, params));
[22c44bf]79}
80
[b5b01e]81ActionState::ptr AtomRotateAroundOriginByAngleAction::performUndo(ActionState::ptr _state) {
[22c44bf]82 AtomRotateAroundOriginByAngleState *state = assert_cast<AtomRotateAroundOriginByAngleState*>(_state.get());
83
[d555b8]84 // convert from degrees to radian
85 double radian = params.angle.get() * M_PI/180.;
86
[22c44bf]87 // Creation Line that is the rotation axis
[f10b0c]88 Line RotationAxis(Vector(0.,0.,0.), state->params.Axis.get());
[22c44bf]89
90 for (std::vector<atom *>::iterator iter = state->selectedAtoms.begin(); iter != state->selectedAtoms.end(); ++iter) {
[d555b8]91 (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), -radian));
[22c44bf]92 }
93
[b5b01e]94 return ActionState::ptr(_state);
[22c44bf]95}
96
[b5b01e]97ActionState::ptr AtomRotateAroundOriginByAngleAction::performRedo(ActionState::ptr _state){
[22c44bf]98 AtomRotateAroundOriginByAngleState *state = assert_cast<AtomRotateAroundOriginByAngleState*>(_state.get());
99
[d555b8]100 // convert from degrees to radian
101 double radian = params.angle.get() * M_PI/180.;
102
[22c44bf]103 // Creation Line that is the rotation axis
[f10b0c]104 Line RotationAxis(Vector(0.,0.,0.), state->params.Axis.get());
[22c44bf]105
106 for (std::vector<atom *>::iterator iter = state->selectedAtoms.begin(); iter != state->selectedAtoms.end(); ++iter) {
[d555b8]107 (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), radian));
[22c44bf]108 }
109
[b5b01e]110 return ActionState::ptr(_state);
[22c44bf]111}
112
113bool AtomRotateAroundOriginByAngleAction::canUndo() {
114 return true;
115}
116
117bool AtomRotateAroundOriginByAngleAction::shouldUndo() {
118 return true;
119}
[1fd675]120/** =========== end of function ====================== */
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