| [0070aa] | 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)  2015 Frederik Heber. All rights reserved. | 
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|  | 5 | * | 
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|  | 6 | * | 
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|  | 7 | *   This file is part of MoleCuilder. | 
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|  | 8 | * | 
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|  | 9 | *    MoleCuilder is free software: you can redistribute it and/or modify | 
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|  | 10 | *    it under the terms of the GNU General Public License as published by | 
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|  | 11 | *    the Free Software Foundation, either version 2 of the License, or | 
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|  | 12 | *    (at your option) any later version. | 
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|  | 13 | * | 
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|  | 14 | *    MoleCuilder is distributed in the hope that it will be useful, | 
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|  | 15 | *    but WITHOUT ANY WARRANTY; without even the implied warranty of | 
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|  | 16 | *    MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the | 
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|  | 17 | *    GNU General Public License for more details. | 
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|  | 18 | * | 
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|  | 19 | *    You should have received a copy of the GNU General Public License | 
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|  | 20 | *    along with MoleCuilder.  If not, see <http://www.gnu.org/licenses/>. | 
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|  | 21 | */ | 
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|  | 22 |  | 
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|  | 23 | /* | 
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|  | 24 | * QtObservedAtom.cpp | 
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|  | 25 | * | 
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|  | 26 | *  Created on: Oct 28, 2015 | 
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|  | 27 | *      Author: heber | 
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|  | 28 | */ | 
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|  | 29 |  | 
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|  | 30 |  | 
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|  | 31 | // include config.h | 
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|  | 32 | #ifdef HAVE_CONFIG_H | 
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|  | 33 | #include <config.h> | 
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|  | 34 | #endif | 
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|  | 35 |  | 
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|  | 36 | #include "QtObservedAtom.hpp" | 
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|  | 37 |  | 
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| [65c323] | 38 | #include "UIElements/Qt4/InstanceBoard/QtObservedInstanceBoard.hpp" | 
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|  | 39 |  | 
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| [0070aa] | 40 | #include "CodePatterns/MemDebug.hpp" | 
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|  | 41 |  | 
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| [65c323] | 42 | #include <boost/assign.hpp> | 
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|  | 43 |  | 
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|  | 44 | #include "Atom/atom.hpp" | 
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|  | 45 | #include "Bond/bond.hpp" | 
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|  | 46 | #include "Descriptors/AtomIdDescriptor.hpp" | 
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|  | 47 | #include "Element/element.hpp" | 
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|  | 48 | #include "World.hpp" | 
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|  | 49 |  | 
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| [494478] | 50 | #include "UIElements/Qt4/InstanceBoard/ObservedValue_wCallback.hpp" | 
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| [65c323] | 51 |  | 
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|  | 52 | using namespace boost::assign; | 
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|  | 53 |  | 
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|  | 54 | static const Observable::channels_t getAtomBondsChannels() | 
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|  | 55 | { | 
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|  | 56 | Observable::channels_t channels; | 
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|  | 57 | channels += AtomObservable::BondsAdded, AtomObservable::BondsRemoved; | 
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|  | 58 | return channels; | 
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|  | 59 | } | 
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|  | 60 |  | 
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|  | 61 | static const Observable::channels_t getAllObservedChannels() | 
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|  | 62 | { | 
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|  | 63 | Observable::channels_t channels; | 
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|  | 64 | channels += | 
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|  | 65 | AtomObservable::IndexChanged, | 
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|  | 66 | AtomObservable::BondsAdded, | 
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| [fe493f] | 67 | AtomObservable::BondsRemoved, | 
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|  | 68 | AtomObservable::MoleculeChanged, | 
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|  | 69 | AtomObservable::NameChanged, | 
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|  | 70 | AtomObservable::ElementChanged, | 
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| [9e9100] | 71 | AtomObservable::PositionChanged, | 
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|  | 72 | AtomObservable::SelectionChanged; | 
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| [65c323] | 73 | return channels; | 
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|  | 74 | } | 
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|  | 75 |  | 
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|  | 76 | // static entities | 
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|  | 77 | const Observable::channels_t | 
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|  | 78 | QtObservedAtom::AtomIndexChannels(1, AtomObservable::IndexChanged); | 
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|  | 79 | const Observable::channels_t | 
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| [fe493f] | 80 | QtObservedAtom::AtomBondsChannels(getAtomBondsChannels()); | 
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| [65c323] | 81 | const Observable::channels_t | 
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|  | 82 | QtObservedAtom::AtomElementChannels(1, AtomObservable::ElementChanged); | 
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|  | 83 | const Observable::channels_t | 
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| [273c8a] | 84 | QtObservedAtom::MoleculeChangedChannels(1, AtomObservable::MoleculeChanged); | 
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| [fe493f] | 85 | const Observable::channels_t | 
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|  | 86 | QtObservedAtom::AtomNameChannels(1, AtomObservable::NameChanged); | 
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|  | 87 | const Observable::channels_t | 
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|  | 88 | QtObservedAtom::AtomPositionChannels(1, AtomObservable::PositionChanged); | 
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| [9e9100] | 89 | const Observable::channels_t | 
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|  | 90 | QtObservedAtom::AtomSelectedChannels(1, AtomObservable::SelectionChanged); | 
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| [65c323] | 91 |  | 
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| [98c35c] | 92 | QtObservedAtom::QtObservedAtom( | 
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| [62a0ee] | 93 | const atomId_t _id, | 
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|  | 94 | const atom * const _atom, | 
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| [65c323] | 95 | QtObservedInstanceBoard &_board, | 
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| [98c35c] | 96 | QWidget * _parent) : | 
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| [0070aa] | 97 | QWidget(_parent), | 
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| [98c35c] | 98 | Observer("QtObservedAtom"), | 
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| [65c323] | 99 | subjectKilledCount(0), | 
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|  | 100 | AllsignedOnChannels(getAllObservedChannels().size()), | 
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|  | 101 | signedOffChannels(0), | 
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|  | 102 | owner(NULL), | 
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| [08a7ecc] | 103 | index(static_cast<const ObservedValue_Index_t>(const_cast<const QtObservedAtom * const>(this))), | 
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| [65c323] | 104 | board(_board), | 
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| [04c3a3] | 105 | BoardIsGone(false), | 
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| [62a0ee] | 106 | ObservedValues(QtObservedAtom::MAX_ObservedTypes) | 
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| [65c323] | 107 | { | 
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| [d48a16] | 108 | boost::function<void ()> atomSubjectKilled( | 
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| [62a0ee] | 109 | boost::bind(&QtObservedAtom::countValuesSubjectKilled, | 
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|  | 110 | boost::ref(*this), | 
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| [ee3fb8] | 111 | boost::bind(&QtObservedAtom::getIndex, boost::ref(*this)))); | 
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| [62a0ee] | 112 | initObservedValues( ObservedValues, _id, _atom, atomSubjectKilled); | 
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|  | 113 |  | 
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|  | 114 | // activating Observer is done by ObservedValueContainer when it's inserted | 
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| [65c323] | 115 | } | 
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| [0070aa] | 116 |  | 
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|  | 117 | QtObservedAtom::~QtObservedAtom() | 
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| [65c323] | 118 | { | 
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| [ee3fb8] | 119 | boost::any_cast<ObservedValue_wCallback<atomId_t, ObservedValue_Index_t> *>(ObservedValues[AtomIndex])->noteCallBackIsGone(); | 
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|  | 120 | boost::any_cast<ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t> *>(ObservedValues[AtomBonds])->noteCallBackIsGone(); | 
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|  | 121 | boost::any_cast<ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t> *>(ObservedValues[AtomElement])->noteCallBackIsGone(); | 
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| [273c8a] | 122 | boost::any_cast<ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t> *>(ObservedValues[MoleculeRef])->noteCallBackIsGone(); | 
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| [ee3fb8] | 123 | boost::any_cast<ObservedValue_wCallback<std::string, ObservedValue_Index_t> *>(ObservedValues[AtomName])->noteCallBackIsGone(); | 
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|  | 124 | boost::any_cast<ObservedValue_wCallback<Vector, ObservedValue_Index_t> *>(ObservedValues[AtomPosition])->noteCallBackIsGone(); | 
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|  | 125 | boost::any_cast<ObservedValue_wCallback<bool, ObservedValue_Index_t> *>(ObservedValues[AtomSelected])->noteCallBackIsGone(); | 
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| [04c3a3] | 126 |  | 
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| [65c323] | 127 | deactivateObserver(); | 
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| [c44763] | 128 |  | 
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|  | 129 | destroyObservedValues(ObservedValues); | 
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| [65c323] | 130 | } | 
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|  | 131 |  | 
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|  | 132 | const atom * const QtObservedAtom::getAtomConst(const atomId_t _id) | 
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|  | 133 | { | 
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|  | 134 | const atom * const _atom = const_cast<const World &>(World::getInstance()). | 
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|  | 135 | getAtom(AtomById(_id)); | 
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|  | 136 | return _atom; | 
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|  | 137 | } | 
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|  | 138 |  | 
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|  | 139 | atom * const QtObservedAtom::getAtom(const atomId_t _id) | 
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|  | 140 | { | 
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|  | 141 | atom * const _atom = World::getInstance().getAtom(AtomById(_id)); | 
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|  | 142 | return _atom; | 
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|  | 143 | } | 
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|  | 144 |  | 
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| [f35f7e] | 145 | #ifdef HAVE_INLINE | 
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|  | 146 | inline | 
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|  | 147 | #endif | 
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|  | 148 | atomId_t QtObservedAtom::updateIndex(const atom &_atomref) | 
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| [65c323] | 149 | { | 
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| [f35f7e] | 150 | return _atomref.getId(); | 
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| [65c323] | 151 | } | 
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|  | 152 |  | 
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| [fe493f] | 153 | QtObservedAtom::ListOfBonds_t QtObservedAtom::updateBonds( | 
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| [f35f7e] | 154 | const atom &_atom) | 
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| [65c323] | 155 | { | 
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| [fe493f] | 156 | ListOfBonds_t ListOfBonds; | 
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| [f35f7e] | 157 | // make sure bonds is up-to-date | 
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|  | 158 | const BondList ListBonds = _atom.getListOfBonds(); | 
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|  | 159 | for (BondList::const_iterator iter = ListBonds.begin(); | 
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|  | 160 | iter != ListBonds.end(); | 
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|  | 161 | ++iter) | 
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|  | 162 | ListOfBonds.insert( ListOfBonds.end(), std::make_pair( | 
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|  | 163 | (*iter)->leftatom->getId(), | 
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|  | 164 | (*iter)->rightatom->getId()) ); | 
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| [fe493f] | 165 | return ListOfBonds; | 
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| [65c323] | 166 | } | 
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|  | 167 |  | 
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| [f35f7e] | 168 | #ifdef HAVE_INLINE | 
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|  | 169 | inline | 
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|  | 170 | #endif | 
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| [65c323] | 171 | atomicNumber_t QtObservedAtom::updateElement( | 
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| [f35f7e] | 172 | const atom &_atom) | 
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| [65c323] | 173 | { | 
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| [f35f7e] | 174 | return _atom.getElementNo(); | 
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| [65c323] | 175 | } | 
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|  | 176 |  | 
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| [f35f7e] | 177 | #ifdef HAVE_INLINE | 
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|  | 178 | inline | 
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|  | 179 | #endif | 
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| [273c8a] | 180 | QtObservedMolecule* QtObservedAtom::updateMoleculeRef( | 
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| [f35f7e] | 181 | const atom &_atom) | 
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| [fe493f] | 182 | { | 
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| [f35f7e] | 183 | if (_atom.getMolecule() != NULL) { | 
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|  | 184 | const moleculeId_t molid = _atom.getMolecule()->getId(); | 
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| [273c8a] | 185 | const QtObservedMolecule::ptr mol = board.getObservedMolecule(molid); | 
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|  | 186 | ASSERT(mol, | 
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|  | 187 | "QtObservedAtom::updateMoleculeRef() - could not update the ref, " | 
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|  | 188 | +toString(molid)+" unknown to Instance board?"); | 
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|  | 189 | return mol.get(); | 
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| [fe493f] | 190 | } else { | 
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| [273c8a] | 191 | return (QtObservedMolecule*)NULL; | 
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| [fe493f] | 192 | } | 
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|  | 193 | } | 
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|  | 194 |  | 
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| [f35f7e] | 195 | #ifdef HAVE_INLINE | 
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|  | 196 | inline | 
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|  | 197 | #endif | 
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| [fe493f] | 198 | std::string QtObservedAtom::updateName( | 
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| [f35f7e] | 199 | const atom &_atom) | 
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| [65c323] | 200 | { | 
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| [f35f7e] | 201 | return _atom.getName(); | 
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| [fe493f] | 202 | } | 
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|  | 203 |  | 
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| [f35f7e] | 204 | #ifdef HAVE_INLINE | 
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|  | 205 | inline | 
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|  | 206 | #endif | 
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| [fe493f] | 207 | Vector QtObservedAtom::updatePosition( | 
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| [f35f7e] | 208 | const atom &_atom) | 
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| [fe493f] | 209 | { | 
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| [f35f7e] | 210 | return _atom.getPosition(); | 
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| [65c323] | 211 | } | 
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| [98c35c] | 212 |  | 
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| [f35f7e] | 213 | #ifdef HAVE_INLINE | 
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|  | 214 | inline | 
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|  | 215 | #endif | 
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| [9e9100] | 216 | bool QtObservedAtom::updateSelected( | 
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| [f35f7e] | 217 | const atom &_atom) | 
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| [9e9100] | 218 | { | 
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| [f35f7e] | 219 | return _atom.getSelected(); | 
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| [9e9100] | 220 | } | 
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|  | 221 |  | 
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| [98c35c] | 222 | void QtObservedAtom::update(Observable *publisher) | 
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| [65c323] | 223 | { | 
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|  | 224 | ASSERT(0, "QtObservedAtom::update() - we are not signed on for global updates."); | 
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|  | 225 | } | 
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| [98c35c] | 226 |  | 
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|  | 227 | void QtObservedAtom::subjectKilled(Observable *publisher) | 
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| [65c323] | 228 | { | 
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|  | 229 | ++signedOffChannels; | 
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|  | 230 |  | 
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| [ee3fb8] | 231 | checkForRemoval(getIndex()); | 
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| [62a0ee] | 232 | } | 
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|  | 233 |  | 
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| [ee3fb8] | 234 | void QtObservedAtom::countValuesSubjectKilled(ObservedValue_Index_t _id) | 
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| [62a0ee] | 235 | { | 
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| [ee3fb8] | 236 | ASSERT( _id == getIndex(), | 
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|  | 237 | "QtObservedAtom::countValuesSubjectKilled() - atom "+toString(getIndex()) | 
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| [62a0ee] | 238 | +" received countValuesSubjectKilled for atom id "+toString(_id)+"."); | 
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|  | 239 |  | 
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|  | 240 | ++subjectKilledCount; | 
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|  | 241 |  | 
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| [ee3fb8] | 242 | checkForRemoval(_id); | 
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| [62a0ee] | 243 | } | 
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|  | 244 |  | 
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|  | 245 | #ifdef HAVE_INLINE | 
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|  | 246 | inline | 
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|  | 247 | #endif | 
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| [ee3fb8] | 248 | void QtObservedAtom::checkForRemoval(ObservedValue_Index_t _id) | 
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| [62a0ee] | 249 | { | 
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|  | 250 | if ((signedOffChannels == AllsignedOnChannels) && (subjectKilledCount == MAX_ObservedTypes)) { | 
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| [65c323] | 251 | // remove owner: no more signOff needed | 
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|  | 252 | owner = NULL; | 
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|  | 253 |  | 
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| [fe493f] | 254 | emit atomRemoved(); | 
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| [4e6ffe] | 255 |  | 
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|  | 256 | if (!BoardIsGone) { | 
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| [ee3fb8] | 257 | board.markObservedAtomAsDisconnected(_id); | 
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|  | 258 | board.markObservedAtomForErase(_id); | 
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| [4e6ffe] | 259 | } | 
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| [65c323] | 260 | } | 
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|  | 261 | } | 
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| [98c35c] | 262 |  | 
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|  | 263 | void QtObservedAtom::recieveNotification(Observable *publisher, Notification_ptr notification) | 
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| [65c323] | 264 | { | 
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|  | 265 | // ObservedValues have been updated before, hence convert updates to Qt's signals | 
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|  | 266 | switch (notification->getChannelNo()) { | 
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|  | 267 | case AtomObservable::IndexChanged: | 
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| [1c0961] | 268 | { | 
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| [522c45] | 269 | emit indexChanged(); | 
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| [65c323] | 270 | break; | 
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| [1c0961] | 271 | } | 
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| [fe493f] | 272 | case AtomObservable::BondsAdded: | 
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|  | 273 | case AtomObservable::BondsRemoved: | 
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|  | 274 | emit bondsChanged(); | 
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| [65c323] | 275 | break; | 
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|  | 276 | case AtomObservable::ElementChanged: | 
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|  | 277 | emit elementChanged(); | 
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|  | 278 | break; | 
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| [fe493f] | 279 | case AtomObservable::MoleculeChanged: | 
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| [1187c5] | 280 | emit moleculeChanged(); | 
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| [fe493f] | 281 | break; | 
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|  | 282 | case AtomObservable::NameChanged: | 
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|  | 283 | emit nameChanged(); | 
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|  | 284 | break; | 
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|  | 285 | case AtomObservable::PositionChanged: | 
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|  | 286 | emit positionChanged(); | 
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| [65c323] | 287 | break; | 
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| [9e9100] | 288 | case AtomObservable::SelectionChanged: | 
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|  | 289 | emit selectedChanged(); | 
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|  | 290 | break; | 
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| [65c323] | 291 | default: | 
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|  | 292 | ASSERT(0, "QtObservedAtom::recieveNotification() - we are not signed on to channel " | 
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|  | 293 | +toString(notification->getChannelNo())+" of the atom."); | 
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|  | 294 | break; | 
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|  | 295 | } | 
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|  | 296 | } | 
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|  | 297 |  | 
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|  | 298 | void QtObservedAtom::activateObserver() | 
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|  | 299 | { | 
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|  | 300 | atom * atomref = getAtom(getAtomIndex()); | 
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|  | 301 | if (atomref != NULL) { | 
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|  | 302 | Observable::channels_t channels = getAllObservedChannels(); | 
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|  | 303 | owner = static_cast<const Observable *>(atomref); | 
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|  | 304 | for (Observable::channels_t::const_iterator iter = channels.begin(); | 
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|  | 305 | iter != channels.end(); ++iter) | 
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|  | 306 | owner->signOn(this, *iter); | 
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| [04c3a3] | 307 | if (!BoardIsGone) | 
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| [59eabc] | 308 | board.markObservedAtomAsConnected(getIndex()); | 
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| [65c323] | 309 | } else | 
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| [04c3a3] | 310 | signedOffChannels = AllsignedOnChannels; | 
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| [65c323] | 311 | } | 
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|  | 312 |  | 
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|  | 313 | void QtObservedAtom::deactivateObserver() | 
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|  | 314 | { | 
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|  | 315 | // sign Off | 
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|  | 316 | if (owner != NULL) { | 
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|  | 317 | Observable::channels_t channels = getAllObservedChannels(); | 
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|  | 318 | for (Observable::channels_t::const_iterator iter = channels.begin(); | 
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|  | 319 | iter != channels.end(); ++iter) | 
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|  | 320 | owner->signOff(this, *iter); | 
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|  | 321 | owner = NULL; | 
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|  | 322 | signedOffChannels = AllsignedOnChannels; | 
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| [04c3a3] | 323 | if (!BoardIsGone) | 
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| [59eabc] | 324 | board.markObservedAtomAsDisconnected(getIndex()); | 
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| [65c323] | 325 | } | 
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|  | 326 | } | 
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|  | 327 |  | 
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|  | 328 | void QtObservedAtom::initObservedValues( | 
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|  | 329 | ObservedValues_t &_ObservedValues, | 
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|  | 330 | const atomId_t _id, | 
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|  | 331 | const atom * const _atomref, | 
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| [d48a16] | 332 | const boost::function<void()> &_subjectKilled) | 
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| [65c323] | 333 | { | 
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|  | 334 | ASSERT( _ObservedValues.size() == MAX_ObservedTypes, | 
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|  | 335 | "QtObservedAtom::initObservedValues() - given ObservedValues has not correct size."); | 
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|  | 336 |  | 
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|  | 337 | // fill ObservedValues: then all the other that need index | 
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| [ee3fb8] | 338 | const boost::function<atomId_t ()> AtomIndexUpdater( | 
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|  | 339 | boost::bind(&QtObservedAtom::updateIndex, boost::cref(*_atomref))); | 
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| [65c323] | 340 | const boost::function<ListOfBonds_t ()> AtomBondsUpdater( | 
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| [f35f7e] | 341 | boost::bind(&QtObservedAtom::updateBonds, boost::cref(*_atomref))); | 
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| [fe493f] | 342 | const boost::function<atomicNumber_t ()> AtomElementUpdater( | 
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| [f35f7e] | 343 | boost::bind(&QtObservedAtom::updateElement, boost::cref(*_atomref))); | 
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| [fe493f] | 344 | const boost::function<std::string ()> AtomNameUpdater( | 
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| [f35f7e] | 345 | boost::bind(&QtObservedAtom::updateName, boost::cref(*_atomref))); | 
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| [fe493f] | 346 | const boost::function<Vector ()> AtomPositionUpdater( | 
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| [f35f7e] | 347 | boost::bind(&QtObservedAtom::updatePosition, boost::cref(*_atomref))); | 
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| [9e9100] | 348 | const boost::function<bool ()> AtomSelectedUpdater( | 
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| [f35f7e] | 349 | boost::bind(&QtObservedAtom::updateSelected, boost::cref(*_atomref))); | 
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| [273c8a] | 350 | const boost::function<QtObservedMolecule* ()> MoleculeRefUpdater( | 
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|  | 351 | boost::bind(&QtObservedAtom::updateMoleculeRef, this, boost::cref(*_atomref))); | 
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| [65c323] | 352 |  | 
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| [ee3fb8] | 353 | _ObservedValues[AtomIndex] = new ObservedValue_wCallback<atomId_t, ObservedValue_Index_t>( | 
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|  | 354 | _atomref, | 
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|  | 355 | AtomIndexUpdater, | 
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|  | 356 | "AtomIndex_"+toString(_id), | 
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|  | 357 | _id, | 
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|  | 358 | AtomIndexChannels, | 
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| [d48a16] | 359 | _subjectKilled); | 
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| [ee3fb8] | 360 | _ObservedValues[AtomBonds] = new ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t>( | 
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| [65c323] | 361 | _atomref, | 
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| [fe493f] | 362 | AtomBondsUpdater, | 
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|  | 363 | "AtomBonds_"+toString(_id), | 
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|  | 364 | AtomBondsUpdater(), | 
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|  | 365 | AtomBondsChannels, | 
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| [d48a16] | 366 | _subjectKilled); | 
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| [ee3fb8] | 367 | _ObservedValues[AtomElement] = new ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t>( | 
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| [65c323] | 368 | _atomref, | 
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|  | 369 | AtomElementUpdater, | 
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|  | 370 | "AtomElement"+toString(_id), | 
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|  | 371 | AtomElementUpdater(), | 
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|  | 372 | AtomElementChannels, | 
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| [d48a16] | 373 | _subjectKilled); | 
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| [ee3fb8] | 374 | _ObservedValues[AtomName] = new ObservedValue_wCallback<std::string, ObservedValue_Index_t>( | 
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| [fe493f] | 375 | _atomref, | 
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|  | 376 | AtomNameUpdater, | 
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|  | 377 | "AtomName"+toString(_id), | 
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|  | 378 | AtomNameUpdater(), | 
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|  | 379 | AtomNameChannels, | 
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| [d48a16] | 380 | _subjectKilled); | 
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| [ee3fb8] | 381 | _ObservedValues[AtomPosition] = new ObservedValue_wCallback<Vector, ObservedValue_Index_t>( | 
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| [fe493f] | 382 | _atomref, | 
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|  | 383 | AtomPositionUpdater, | 
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|  | 384 | "AtomPosition_"+toString(_id), | 
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|  | 385 | AtomPositionUpdater(), | 
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|  | 386 | AtomPositionChannels, | 
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| [d48a16] | 387 | _subjectKilled); | 
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| [ee3fb8] | 388 | _ObservedValues[AtomSelected] = new ObservedValue_wCallback<bool, ObservedValue_Index_t>( | 
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| [9e9100] | 389 | _atomref, | 
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|  | 390 | AtomSelectedUpdater, | 
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|  | 391 | "AtomSelected_"+toString(_id), | 
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|  | 392 | AtomSelectedUpdater(), | 
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|  | 393 | AtomSelectedChannels, | 
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| [d48a16] | 394 | _subjectKilled); | 
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| [273c8a] | 395 | _ObservedValues[MoleculeRef] = new ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t>( | 
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|  | 396 | _atomref, | 
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|  | 397 | MoleculeRefUpdater, | 
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|  | 398 | "AtomMoleculeIndex"+toString(_id), | 
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|  | 399 | MoleculeRefUpdater(), | 
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|  | 400 | MoleculeChangedChannels, | 
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|  | 401 | _subjectKilled); | 
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| [65c323] | 402 | } | 
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|  | 403 |  | 
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|  | 404 | void QtObservedAtom::destroyObservedValues( | 
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|  | 405 | std::vector<boost::any> &_ObservedValues) | 
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|  | 406 | { | 
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| [ee3fb8] | 407 | delete boost::any_cast<ObservedValue_wCallback<atomId_t, ObservedValue_Index_t> *>(_ObservedValues[AtomIndex]); | 
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|  | 408 | delete boost::any_cast<ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t> *>(_ObservedValues[AtomBonds]); | 
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|  | 409 | delete boost::any_cast<ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t> *>(_ObservedValues[AtomElement]); | 
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|  | 410 | delete boost::any_cast<ObservedValue_wCallback<std::string, ObservedValue_Index_t> *>(_ObservedValues[AtomName]); | 
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|  | 411 | delete boost::any_cast<ObservedValue_wCallback<Vector, ObservedValue_Index_t> *>(_ObservedValues[AtomPosition]); | 
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|  | 412 | delete boost::any_cast<ObservedValue_wCallback<bool, ObservedValue_Index_t> *>(_ObservedValues[AtomSelected]); | 
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| [273c8a] | 413 | delete boost::any_cast<ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t> *>(_ObservedValues[MoleculeRef]); | 
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| [65c323] | 414 | _ObservedValues.clear(); | 
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|  | 415 | } | 
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|  | 416 |  | 
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| [59eabc] | 417 | ObservedValue_Index_t QtObservedAtom::getIndex() const | 
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|  | 418 | { | 
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| [498c678] | 419 | ASSERT( index != NULL, | 
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| [59eabc] | 420 | "QtObservedAtom::getIndex() - index is NULL"); | 
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| [498c678] | 421 | return index; | 
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| [59eabc] | 422 | } | 
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|  | 423 |  | 
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| [3b9aa1] | 424 | const atomId_t& QtObservedAtom::getAtomIndex() const | 
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| [65c323] | 425 | { | 
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| [ee3fb8] | 426 | return boost::any_cast<ObservedValue_wCallback<atomId_t, ObservedValue_Index_t> *>(ObservedValues[AtomIndex])->get(); | 
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| [65c323] | 427 | } | 
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|  | 428 |  | 
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| [3b9aa1] | 429 | const QtObservedAtom::ListOfBonds_t& QtObservedAtom::getAtomBonds() const | 
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| [65c323] | 430 | { | 
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| [ee3fb8] | 431 | return boost::any_cast<ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t> *>(ObservedValues[AtomBonds])->get(); | 
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| [65c323] | 432 | } | 
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|  | 433 |  | 
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| [3b9aa1] | 434 | const atomicNumber_t& QtObservedAtom::getAtomElement() const | 
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| [65c323] | 435 | { | 
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| [ee3fb8] | 436 | return boost::any_cast<ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t> *>(ObservedValues[AtomElement])->get(); | 
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| [65c323] | 437 | } | 
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|  | 438 |  | 
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| [3b9aa1] | 439 | const std::string& QtObservedAtom::getAtomName() const | 
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| [fe493f] | 440 | { | 
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| [ee3fb8] | 441 | return boost::any_cast<ObservedValue_wCallback<std::string, ObservedValue_Index_t> *>(ObservedValues[AtomName])->get(); | 
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| [fe493f] | 442 | } | 
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|  | 443 |  | 
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| [3b9aa1] | 444 | const Vector& QtObservedAtom::getAtomPosition() const | 
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| [fe493f] | 445 | { | 
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| [ee3fb8] | 446 | return boost::any_cast<ObservedValue_wCallback<Vector, ObservedValue_Index_t> *>(ObservedValues[AtomPosition])->get(); | 
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| [65c323] | 447 | } | 
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| [9e9100] | 448 |  | 
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|  | 449 | const bool QtObservedAtom::getAtomSelected() const | 
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|  | 450 | { | 
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| [ee3fb8] | 451 | return boost::any_cast<ObservedValue_wCallback<bool, ObservedValue_Index_t> *>(ObservedValues[AtomSelected])->get(); | 
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| [9e9100] | 452 | } | 
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| [273c8a] | 453 |  | 
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|  | 454 | const QtObservedMolecule* const QtObservedAtom::getMoleculeRef() const | 
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|  | 455 | { | 
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|  | 456 | return boost::any_cast<ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t> *>(ObservedValues[MoleculeRef])->get(); | 
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|  | 457 | } | 
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