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 | * CenterOnEdgeAction.cpp
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10 | *
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11 | * Created on: May 8, 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/WorldAction/CenterOnEdgeAction.hpp"
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23 | #include "Actions/ActionRegistry.hpp"
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24 | #include "atom.hpp"
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25 | #include "Helpers/Log.hpp"
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26 | #include "LinearAlgebra/Vector.hpp"
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27 | #include "World.hpp"
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28 | #include "LinearAlgebra/Matrix.hpp"
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29 |
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30 | #include <iostream>
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31 | #include <string>
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32 |
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33 | using namespace std;
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34 |
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35 | #include "UIElements/UIFactory.hpp"
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36 | #include "UIElements/Dialog.hpp"
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37 | #include "Actions/ValueStorage.hpp"
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38 | #include "Helpers/Assert.hpp"
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39 |
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40 | const char WorldCenterOnEdgeAction::NAME[] = "center-edge";
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41 |
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42 | WorldCenterOnEdgeAction::WorldCenterOnEdgeAction() :
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43 | Action(NAME)
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44 | {}
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45 |
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46 | WorldCenterOnEdgeAction::~WorldCenterOnEdgeAction()
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47 | {}
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48 |
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49 | void WorldCenterOnEdge() {
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50 | ActionRegistry::getInstance().getActionByName(WorldCenterOnEdgeAction::NAME)->call(Action::NonInteractive);
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51 | };
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52 |
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53 | void WorldCenterOnEdgeAction::getParametersfromValueStorage()
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54 | {};
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55 |
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56 | Dialog* WorldCenterOnEdgeAction::fillDialog(Dialog *dialog) {
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57 | ASSERT(dialog,"No Dialog given when filling action dialog");
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58 |
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59 | dialog->queryEmpty(NAME, ValueStorage::getInstance().getDescription(NAME));
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60 |
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61 | return dialog;
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62 | }
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63 |
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64 | Action::state_ptr WorldCenterOnEdgeAction::performCall() {
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65 | Vector Min;
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66 | Vector Max;
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67 |
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68 | // get maximum and minimum
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69 | vector<atom *> AllAtoms = World::getInstance().getAllAtoms();
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70 | ASSERT(AllAtoms.size() > 0, "For CenteronEdge atoms must be present.");
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71 | vector<atom *>::iterator AtomRunner = AllAtoms.begin();
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72 | Min = (*AtomRunner)->getPosition();
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73 | Max = (*AtomRunner)->getPosition();
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74 | for (; AtomRunner != AllAtoms.end(); ++AtomRunner) {
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75 | for (int i=0;i<NDIM;i++) {
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76 | if ((*AtomRunner)->at(i) > Max[i])
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77 | Max[i] = (*AtomRunner)->at(i);
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78 | if ((*AtomRunner)->at(i) < Min[i])
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79 | Min[i] = (*AtomRunner)->at(i);
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80 | }
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81 | }
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82 | // set new box size
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83 | Matrix domain;
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84 | for (int i=0;i<NDIM;i++) {
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85 | double tmp = Max[i]-Min[i];
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86 | tmp = fabs(tmp)>=1. ? tmp : 1.0;
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87 | domain.at(i,i) = tmp;
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88 | }
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89 | World::getInstance().setDomain(domain);
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90 | // translate all atoms, such that Min is aty (0,0,0)
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91 | for (vector<atom*>::iterator AtomRunner = AllAtoms.begin(); AtomRunner != AllAtoms.end(); ++AtomRunner)
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92 | *(*AtomRunner) -= Min;
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93 |
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94 | return Action::success;
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95 | }
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96 |
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97 | Action::state_ptr WorldCenterOnEdgeAction::performUndo(Action::state_ptr _state) {
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98 | // ParserLoadXyzState *state = assert_cast<ParserLoadXyzState*>(_state.get());
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99 |
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100 | return Action::failure;
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101 | // string newName = state->mol->getName();
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102 | // state->mol->setName(state->lastName);
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103 | //
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104 | // return Action::state_ptr(new ParserLoadXyzState(state->mol,newName));
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105 | }
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106 |
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107 | Action::state_ptr WorldCenterOnEdgeAction::performRedo(Action::state_ptr _state){
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108 | return Action::failure;
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109 | }
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110 |
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111 | bool WorldCenterOnEdgeAction::canUndo() {
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112 | return false;
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113 | }
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114 |
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115 | bool WorldCenterOnEdgeAction::shouldUndo() {
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116 | return false;
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117 | }
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118 |
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119 | const string WorldCenterOnEdgeAction::getName() {
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120 | return NAME;
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121 | }
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