1 | /*
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2 | * GLMoleculeObject_atom.hpp
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3 | *
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4 | * Created on: Aug 17, 2011
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5 | * Author: heber
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6 | */
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7 |
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8 | #ifndef GLMOLECULEOBJECT_ATOM_HPP_
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9 | #define GLMOLECULEOBJECT_ATOM_HPP_
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10 |
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11 | // include config.h
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12 | #ifdef HAVE_CONFIG_H
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13 | #include <config.h>
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14 | #endif
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15 |
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16 | #include "GLMoleculeObject.hpp"
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17 |
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18 | #include <vector>
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19 | #include <boost/any.hpp>
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20 |
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21 | #include "CodePatterns/ObservedValue.hpp"
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22 | #include "CodePatterns/Observer/Observer.hpp"
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23 |
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24 | #include "LinearAlgebra/Vector.hpp"
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25 |
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26 | #include "Bond/bond.hpp"
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27 | #include "UIElements/Views/Qt4/Qt3D/GLMoleculeObject_bond.hpp"
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28 | #include "types.hpp"
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29 |
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30 | class GLWorldScene;
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31 | class QtInstanceInformationBoard;
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32 |
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33 | class GLMoleculeObject_atom : public GLMoleculeObject, Observer
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34 | {
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35 | Q_OBJECT
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36 | public:
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37 | GLMoleculeObject_atom(
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38 | QGLSceneNode *mesh[],
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39 | QObject *parent,
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40 | const atomId_t id
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41 | );
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42 | GLMoleculeObject_atom(
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43 | QGLSceneNode *mesh[],
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44 | QObject *parent,
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45 | const atomId_t id,
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46 | std::vector<boost::any> _ObservedValues
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47 | );
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48 | virtual ~GLMoleculeObject_atom();
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49 |
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50 | void draw(QGLPainter *painter, const QVector4D &cameraPlane);
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51 |
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52 | // Observer functions
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53 | void update(Observable *publisher);
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54 | void subjectKilled(Observable *publisher);
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55 | void recieveNotification(Observable *publisher, Notification_ptr notification);
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56 |
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57 | public slots:
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58 | void Selected();
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59 | void Unselected();
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60 |
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61 | private slots:
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62 | void wasClicked();
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63 | void resetIndex();
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64 | void resetElement();
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65 | void resetPosition();
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66 | void resetBonds();
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67 |
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68 | signals:
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69 | void clicked(atomId_t);
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70 | void BondsAdded(const atomId_t _left, const atomId_t _right, const GLMoleculeObject_bond::SideOfBond side);
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71 | void BondsRemoved(const atomId_t _left, const atomId_t _right);
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72 | void indexChanged(GLMoleculeObject_atom *ob, const atomId_t oldId, const atomId_t newId);
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73 | void idChanged();
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74 | void positionChanged();
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75 | void elementChanged();
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76 | void bondsChanged();
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77 | void InstanceRemoved(const atomId_t);
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78 |
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79 | private:
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80 | //!> grant GLMoleculeObject_molecule acess to reset functions
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81 | friend class GLMoleculeObject_molecule;
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82 |
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83 | //!> typedef for list of bonds, defined by pairs of atom ids
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84 | typedef std::vector< std::pair<atomId_t, atomId_t> > ListOfBonds_t;
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85 |
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86 | static const atom * const getAtomConst(const atomId_t _id);
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87 | static atom * const getAtom(const atomId_t _id);
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88 |
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89 | static atomId_t updateIndex();
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90 | static Vector updatePosition(
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91 | const boost::function<const atomId_t ()> &_getAtomIndex);
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92 | static atomicNumber_t updateElement(
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93 | const boost::function<const atomId_t ()> &_getAtomIndex);
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94 | static ListOfBonds_t updateBonds(
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95 | const boost::function<const atomId_t ()> &_getAtomIndex);
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96 |
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97 | void activateObserver();
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98 | void deactivateObserver();
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99 |
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100 | void init(const atomId_t _id);
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101 |
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102 | private:
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103 |
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104 | //!> current list of bonds to compare new onw against for changes
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105 | ListOfBonds_t ListOfBonds;
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106 |
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107 | //!> temporary variable used in cstor
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108 | atom * const atomref;
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109 |
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110 | private:
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111 | friend class QtInstanceInformationBoard;
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112 | /** Observed Values **/
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113 |
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114 | //!> enumeration of observed values to match with entries in ObservedValues
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115 | enum ObservedTypes {
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116 | //!> contains the current atom index
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117 | AtomIndex,
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118 | //!> contains the current atom position
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119 | AtomPosition,
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120 | //!> contains the current atom element
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121 | AtomElement,
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122 | //!> contains the current set of bonds atoms fort the atom
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123 | AtomBonds,
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124 | //!> gives the size of the enumeration
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125 | MAX_ObservedTypes
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126 | };
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127 |
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128 | //!> vector with all observed values
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129 | std::vector<boost::any> ObservedValues;
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130 |
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131 | /** Initializes all \a ObservedValues entries.
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132 | *
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133 | * \param _ObservedValues vector of ObservedValue to be filled
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134 | * \param _id atom id
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135 | * \param _atomref reference to atom
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136 | * \param _subjectKilled ref to function to call on subjectKilled()
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137 | */
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138 | static void initObservedValues(
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139 | std::vector<boost::any> &_ObservedValues,
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140 | const atomId_t _id,
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141 | const atom * const _atomref,
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142 | const boost::function<void(const atomId_t)> &_subjectKilled);
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143 |
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144 | /** Destroys all \a ObservedValues entries.
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145 | *
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146 | * \param _ObservedValues vector of ObservedValue to be destroyed
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147 | */
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148 | static void destroyObservedValues(
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149 | std::vector<boost::any> &_ObservedValues);
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150 |
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151 | /** Getter to atom index contained in \a ObservedValues.
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152 | *
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153 | * \return atom's index
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154 | */
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155 | atomId_t getAtomIndex() const;
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156 |
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157 | /** Getter to atom position contained in \a ObservedValues.
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158 | *
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159 | * \return atom's position
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160 | */
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161 | Vector getAtomPosition() const;
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162 |
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163 | /** Getter to atom element contained in \a ObservedValues.
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164 | *
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165 | * \return atom's elemnt
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166 | */
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167 | atomicNumber_t getAtomElement() const;
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168 |
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169 | /** Getter to atom bonds contained in \a ObservedValues.
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170 | *
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171 | * \return atom's bonds
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172 | */
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173 | ListOfBonds_t getAtomBonds() const;
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174 |
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175 | /** Counts how many ObservedValues got subjectKilled.
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176 | *
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177 | * This is used to give InstanceRemoved() signal only when each and every
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178 | * ObservedValue (and the instance itself) has been subjectKilled by the
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179 | * monitored Observable. Only then can we safely remove the instance.
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180 | *
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181 | * \param _atomid id of atom who signalled subjectKilled()
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182 | */
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183 | void countsubjectKilled(const atomId_t _atomid);
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184 |
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185 | //!> counts how many ObservedValues have already been subjectKilled()
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186 | mutable size_t subjectKilledCount;
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187 |
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188 | private:
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189 |
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190 | //!> list of channels when index needs to update
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191 | static const Observable::channels_t AtomIndexChannels;
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192 | //!> list of channels when position needs to update
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193 | static const Observable::channels_t AtomPositionChannels;
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194 | //!> list of channels when element needs to update
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195 | static const Observable::channels_t AtomElementChannels;
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196 | //!> list of channels when bonds needs to update
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197 | static const Observable::channels_t AtomBondsChannels;
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198 |
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199 | //!> the Observable we are signed on, also indicates whether we are sign on (not NULL)
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200 | const Observable *owner;
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201 | };
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202 |
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203 |
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204 |
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205 | #endif /* GLMOLECULEOBJECT_ATOM_HPP_ */
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