| 1 | /*
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| 2 | * GLMoleculeObject_bond.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_BOND_HPP_
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| 9 | #define GLMOLECULEOBJECT_BOND_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/Observer/Observer.hpp"
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| 22 | #include "CodePatterns/ObservedValue.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 "types.hpp"
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| 28 |
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| 29 | class atom;
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| 30 |
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| 31 | class GLWorldScene;
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| 32 |
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| 33 | class GLMoleculeObject_bond : public GLMoleculeObject, public Observer
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| 34 | {
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| 35 | Q_OBJECT
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| 36 | public:
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| 37 | enum SideOfBond { left, right };
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| 38 |
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| 39 | typedef std::pair<atomId_t, atomId_t> bondIds_t;
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| 40 |
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| 41 | GLMoleculeObject_bond(QGLSceneNode *mesh[], QObject *parent, const bondIds_t bondIds, const enum SideOfBond side);
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| 42 | virtual ~GLMoleculeObject_bond();
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| 43 |
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| 44 | // Observer functions
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| 45 | void update(Observable *publisher);
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| 46 | void subjectKilled(Observable *publisher);
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| 47 | void recieveNotification(Observable *publisher, Notification_ptr notification);
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| 48 |
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| 49 | signals:
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| 50 | void BondRemoved(const atomId_t leftnr, const atomId_t rightnr);
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| 51 | void elementChanged();
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| 52 | void positionChanged();
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| 53 | void degreeChanged();
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| 54 |
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| 55 | private slots:
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| 56 | //!> grant GLMoleculeObject_molecule acess to reset functions
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| 57 | friend class GLMoleculeObject_molecule;
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| 58 |
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| 59 | /** Recalculates the element of the cylinder representing the bond.
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| 60 | *
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| 61 | */
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| 62 | void resetElement();
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| 63 |
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| 64 | /** Recalculates the position of the cylinder representing the bond.
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| 65 | *
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| 66 | */
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| 67 | void resetPosition();
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| 68 |
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| 69 | /** Recalculates the width of the cylinder representing the bond's degree.
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| 70 | *
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| 71 | */
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| 72 | void resetWidth();
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| 73 |
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| 74 | private:
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| 75 | void removeChannels();
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| 76 |
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| 77 | Vector updateLeftPosition() const;
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| 78 | Vector updateRightPosition() const;
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| 79 | atomicNumber_t updateLeftElement() const;
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| 80 | atomicNumber_t updateRightElement() const;
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| 81 | int updateDegree() const;
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| 82 |
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| 83 | static const atom * const getAtomConst(const atomId_t _id);
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| 84 | static atom * const getAtom(const atomId_t _id);
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| 85 |
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| 86 | private:
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| 87 | //!> id of left bond partner for safely emitting BondRemoved signal
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| 88 | const atomId_t leftatomId;
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| 89 | //!> id of right bond partner for safely emitting BondRemoved signal
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| 90 | const atomId_t rightatomId;
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| 91 |
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| 92 | //!> contains ref to Observable of left atom
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| 93 | const Observable * const leftowner;
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| 94 | //!> contains ref to Observable of right atom
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| 95 | const Observable * const rightowner;
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| 96 | //!> temporary variable used in cstor
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| 97 | const Observable * const bondowner;
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| 98 |
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| 99 | const enum SideOfBond BondSide;
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| 100 |
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| 101 |
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| 102 | private:
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| 103 | /** Observed Values **/
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| 104 |
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| 105 | //!> enumeration of observed values to match with entries in ObservedValues
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| 106 | enum ObservedTypes {
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| 107 | //!> contains the position of the left atom
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| 108 | leftPosition,
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| 109 | //!> contains the position of the right atom
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| 110 | rightPosition,
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| 111 | //!> contains the element of the left atom
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| 112 | leftElement,
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| 113 | //!> contains the element of the right atom
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| 114 | rightElement,
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| 115 | //!> contains the degree of the bond
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| 116 | Degree,
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| 117 | //!> gives the size of the enumeration
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| 118 | MAX_ObservedTypes
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| 119 | };
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| 120 |
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| 121 | //!> vector with all observed values
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| 122 | std::vector<boost::any> ObservedValues;
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| 123 |
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| 124 | /** Initializes all \a ObservedValues entries.
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| 125 | *
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| 126 | */
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| 127 | void initObservedValues();
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| 128 |
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| 129 | /** Destroys all \a ObservedValues entries.
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| 130 | *
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| 131 | */
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| 132 | void destroyObservedValues();
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| 133 |
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| 134 | /** Getter to left atom's position contained in \a ObservedValues.
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| 135 | *
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| 136 | * \return left atom's position
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| 137 | */
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| 138 | Vector getleftPosition() const;
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| 139 |
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| 140 | /** Getter to right atom's position contained in \a ObservedValues.
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| 141 | *
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| 142 | * \return right atom's position
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| 143 | */
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| 144 | Vector getrightPosition() const;
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| 145 |
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| 146 | /** Getter to left atom's element contained in \a ObservedValues.
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| 147 | *
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| 148 | * \return left atom's element
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| 149 | */
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| 150 | atomicNumber_t getleftElement() const;
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| 151 |
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| 152 | /** Getter to rightatom's element contained in \a ObservedValues.
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| 153 | *
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| 154 | * \return right atom's element
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| 155 | */
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| 156 | atomicNumber_t getrightElement() const;
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| 157 |
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| 158 | /** Getter to bond's degree contained in \a ObservedValues.
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| 159 | *
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| 160 | * \return bond's degree
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| 161 | */
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| 162 | int getDegree() const;
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| 163 |
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| 164 | /** Counts how many ObservedValues got subjectKilled.
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| 165 | *
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| 166 | * This is used to give InstanceRemoved() signal only when each and every
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| 167 | * ObservedValue (and the instance itself) has been subjectKilled by the
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| 168 | * monitored Observable. Only then can we safely remove the instance.
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| 169 | *
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| 170 | */
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| 171 | void countsubjectKilled();
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| 172 |
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| 173 | //!> counts how many ObservedValues have already been subjectKilled()
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| 174 | mutable size_t subjectKilledCount;
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| 175 |
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| 176 | private:
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| 177 |
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| 178 | //!> indicate whether we are signed in to leftobservable
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| 179 | bool leftobservable_enabled;
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| 180 | //!> indicate whether we are signed in to rightobservable
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| 181 | bool rightobservable_enabled;
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| 182 | //!> indicate whether we are signed in to bond itself
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| 183 | bool bond_enabled;
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| 184 |
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| 185 | //!> list of channels when position needs to update
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| 186 | static const Observable::channels_t BondPositionChannels;
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| 187 | //!>list of channels when degree needs to update
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| 188 | static const Observable::channels_t BondDegreeChannels;
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| 189 | //!> list of channels when element needs to update
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| 190 | static const Observable::channels_t BondElementChannels;
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| 191 | };
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| 192 |
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| 193 |
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| 194 |
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| 195 | #endif /* GLMOLECULEOBJECT_BOND_HPP_ */
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