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) 2010 University of Bonn. All rights reserved.
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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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8 | /*
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9 | * RotateAroundSelfByAngleAction.cpp
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10 | *
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11 | * Created on: Aug 06, 2010
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12 | * Author: heber
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13 | */
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14 |
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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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20 | #include "Helpers/MemDebug.hpp"
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21 |
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22 | #include "Actions/MoleculeAction/RotateAroundSelfByAngleAction.hpp"
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23 | #include "Actions/ActionRegistry.hpp"
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24 | #include "Helpers/Log.hpp"
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25 | #include "Helpers/Verbose.hpp"
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26 | #include "LinearAlgebra/Line.hpp"
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27 | #include "LinearAlgebra/Vector.hpp"
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28 | #include "atom.hpp"
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29 | #include "molecule.hpp"
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30 |
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31 |
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32 | #include <iostream>
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33 | #include <fstream>
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34 | #include <string>
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35 |
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36 | using namespace std;
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37 |
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38 | #include "UIElements/UIFactory.hpp"
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39 | #include "UIElements/Dialog.hpp"
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40 | #include "Actions/ValueStorage.hpp"
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41 |
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42 | /****** MoleculeRotateAroundSelfByAngleAction *****/
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43 |
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44 | // memento to remember the state when undoing
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45 |
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46 | class MoleculeRotateAroundSelfByAngleState : public ActionState {
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47 | public:
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48 | MoleculeRotateAroundSelfByAngleState(molecule * const _mol, const Vector &_Axis, const double _alpha) :
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49 | mol(_mol),
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50 | Axis(_Axis),
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51 | alpha(_alpha)
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52 | {}
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53 | molecule* const mol;
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54 | Vector Axis;
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55 | double alpha;
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56 | };
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57 |
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58 | const char MoleculeRotateAroundSelfByAngleAction::NAME[] = "rotate-self";
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59 |
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60 | MoleculeRotateAroundSelfByAngleAction::MoleculeRotateAroundSelfByAngleAction() :
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61 | Action(NAME)
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62 | {}
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63 |
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64 | MoleculeRotateAroundSelfByAngleAction::~MoleculeRotateAroundSelfByAngleAction()
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65 | {}
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66 |
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67 | void MoleculeRotateAroundSelfByAngle(const Vector &Axis, const double angle) {
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68 | ValueStorage::getInstance().setCurrentValue(MoleculeRotateAroundSelfByAngleAction::NAME, angle);
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69 | ValueStorage::getInstance().setCurrentValue("position", Axis);
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70 | ActionRegistry::getInstance().getActionByName(MoleculeRotateAroundSelfByAngleAction::NAME)->call(Action::NonInteractive);
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71 | };
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72 |
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73 | Dialog* MoleculeRotateAroundSelfByAngleAction::fillDialog(Dialog *dialog) {
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74 | ASSERT(dialog,"No Dialog given when filling action dialog");
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75 |
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76 | dialog->queryDouble(NAME, ValueStorage::getInstance().getDescription(NAME));
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77 | dialog->queryVector("position", false, ValueStorage::getInstance().getDescription(NAME));
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78 |
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79 | return dialog;
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80 | }
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81 |
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82 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performCall() {
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83 | molecule *mol = NULL;
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84 | double alpha = 0.;
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85 | Vector Axis;
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86 |
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87 | // obtain angle and axis around which rotate
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88 | ValueStorage::getInstance().queryCurrentValue(NAME, alpha);
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89 | ValueStorage::getInstance().queryCurrentValue("position", Axis);
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90 |
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91 | // check whether a single atom and molecule is selected
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92 | if (World::getInstance().getSelectedMolecules().size() != 1)
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93 | return Action::failure;
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94 | mol = World::getInstance().beginMoleculeSelection()->second;
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95 |
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96 | // check whether Axis is valid
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97 | if (Axis.IsZero())
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98 | return Action::failure;
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99 |
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100 | // convert from degrees to radian
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101 | alpha *= M_PI/180.;
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102 |
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103 | // Creation Line that is the rotation axis
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104 | Vector *CenterOfGravity = mol->DetermineCenterOfGravity();
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105 | Line RotationAxis(*CenterOfGravity, Axis);
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106 | delete(CenterOfGravity);
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107 | DoLog(0) && (Log() << Verbose(0) << "Rotate around self by " << alpha << " along " << RotationAxis << "." << endl);
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108 |
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109 | for (molecule::iterator iter = mol->begin(); iter != mol->end(); ++iter) {
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110 | (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), alpha));
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111 | }
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112 | DoLog(0) && (Log() << Verbose(0) << "done." << endl);
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113 |
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114 | return Action::state_ptr(new MoleculeRotateAroundSelfByAngleState(mol, Axis, alpha));
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115 | }
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116 |
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117 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performUndo(Action::state_ptr _state) {
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118 | MoleculeRotateAroundSelfByAngleState *state = assert_cast<MoleculeRotateAroundSelfByAngleState*>(_state.get());
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119 |
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120 | Vector *CenterOfGravity = state->mol->DetermineCenterOfGravity();
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121 | Line RotationAxis(*CenterOfGravity, state->Axis);
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122 | delete(CenterOfGravity);
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123 |
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124 | for (molecule::iterator iter = state->mol->begin(); iter != state->mol->end(); ++iter) {
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125 | (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), -state->alpha));
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126 | }
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127 |
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128 | return Action::state_ptr(_state);
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129 | }
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130 |
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131 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performRedo(Action::state_ptr _state){
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132 | MoleculeRotateAroundSelfByAngleState *state = assert_cast<MoleculeRotateAroundSelfByAngleState*>(_state.get());
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133 |
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134 | Vector *CenterOfGravity = state->mol->DetermineCenterOfGravity();
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135 | Line RotationAxis(*CenterOfGravity, state->Axis);
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136 | delete(CenterOfGravity);
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137 |
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138 | for (molecule::iterator iter = state->mol->begin(); iter != state->mol->end(); ++iter) {
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139 | (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), state->alpha));
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140 | }
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141 |
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142 | return Action::state_ptr(_state);
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143 | }
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144 |
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145 | bool MoleculeRotateAroundSelfByAngleAction::canUndo() {
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146 | return true;
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147 | }
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148 |
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149 | bool MoleculeRotateAroundSelfByAngleAction::shouldUndo() {
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150 | return true;
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151 | }
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152 |
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153 | const string MoleculeRotateAroundSelfByAngleAction::getName() {
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154 | return NAME;
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155 | }
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