source: src/UIElements/Qt4/InstanceBoard/QtObservedAtom.cpp@ 3e334e

Candidate_v1.6.1 ChemicalSpaceEvaluator
Last change on this file since 3e334e was 4dfe724, checked in by Frederik Heber <frederik.heber@…>, 8 years ago

FIX: QtGui again reacts to WorldTime changes.

  • QtObservedAtom now observes WorldTime and uses new forceUpdate() for position and molecule ObservedValues to get information of new time step.
  • Note: As WorldTime is a singleton living till the end of the program we do not need any fancy taking care of subjectKilled() in a correct manner.
  • Property mode set to 100644
File size: 15.5 KB
RevLine 
[0070aa]1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2015 Frederik Heber. All rights reserved.
5 *
6 *
7 * This file is part of MoleCuilder.
8 *
9 * MoleCuilder is free software: you can redistribute it and/or modify
10 * it under the terms of the GNU General Public License as published by
11 * the Free Software Foundation, either version 2 of the License, or
12 * (at your option) any later version.
13 *
14 * MoleCuilder is distributed in the hope that it will be useful,
15 * but WITHOUT ANY WARRANTY; without even the implied warranty of
16 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
17 * GNU General Public License for more details.
18 *
19 * You should have received a copy of the GNU General Public License
20 * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
21 */
22
23/*
24 * QtObservedAtom.cpp
25 *
26 * Created on: Oct 28, 2015
27 * Author: heber
28 */
29
30
31// include config.h
32#ifdef HAVE_CONFIG_H
33#include <config.h>
34#endif
35
36#include "QtObservedAtom.hpp"
37
[65c323]38#include "UIElements/Qt4/InstanceBoard/QtObservedInstanceBoard.hpp"
39
[9eb71b3]40//#include "CodePatterns/MemDebug.hpp"
[0070aa]41
[65c323]42#include <boost/assign.hpp>
43
44#include "Atom/atom.hpp"
45#include "Bond/bond.hpp"
46#include "Descriptors/AtomIdDescriptor.hpp"
47#include "Element/element.hpp"
48#include "World.hpp"
[4dfe724]49#include "WorldTime.hpp"
[65c323]50
[494478]51#include "UIElements/Qt4/InstanceBoard/ObservedValue_wCallback.hpp"
[65c323]52
53using namespace boost::assign;
54
55static const Observable::channels_t getAtomBondsChannels()
56{
57 Observable::channels_t channels;
58 channels += AtomObservable::BondsAdded, AtomObservable::BondsRemoved;
59 return channels;
60}
61
62static const Observable::channels_t getAllObservedChannels()
63{
64 Observable::channels_t channels;
65 channels +=
66 AtomObservable::IndexChanged,
67 AtomObservable::BondsAdded,
[fe493f]68 AtomObservable::BondsRemoved,
69 AtomObservable::MoleculeChanged,
70 AtomObservable::NameChanged,
71 AtomObservable::ElementChanged,
[9e9100]72 AtomObservable::PositionChanged,
73 AtomObservable::SelectionChanged;
[65c323]74 return channels;
75}
76
77// static entities
78const Observable::channels_t
79QtObservedAtom::AtomIndexChannels(1, AtomObservable::IndexChanged);
80const Observable::channels_t
[fe493f]81QtObservedAtom::AtomBondsChannels(getAtomBondsChannels());
[65c323]82const Observable::channels_t
83QtObservedAtom::AtomElementChannels(1, AtomObservable::ElementChanged);
84const Observable::channels_t
[273c8a]85QtObservedAtom::MoleculeChangedChannels(1, AtomObservable::MoleculeChanged);
[fe493f]86const Observable::channels_t
87QtObservedAtom::AtomNameChannels(1, AtomObservable::NameChanged);
88const Observable::channels_t
89QtObservedAtom::AtomPositionChannels(1, AtomObservable::PositionChanged);
[9e9100]90const Observable::channels_t
91QtObservedAtom::AtomSelectedChannels(1, AtomObservable::SelectionChanged);
[65c323]92
[98c35c]93QtObservedAtom::QtObservedAtom(
[62a0ee]94 const atomId_t _id,
95 const atom * const _atom,
[65c323]96 QtObservedInstanceBoard &_board,
[98c35c]97 QWidget * _parent) :
[0070aa]98 QWidget(_parent),
[98c35c]99 Observer("QtObservedAtom"),
[65c323]100 subjectKilledCount(0),
101 AllsignedOnChannels(getAllObservedChannels().size()),
102 signedOffChannels(0),
103 owner(NULL),
[08a7ecc]104 index(static_cast<const ObservedValue_Index_t>(const_cast<const QtObservedAtom * const>(this))),
[65c323]105 board(_board),
[04c3a3]106 BoardIsGone(false),
[62a0ee]107 ObservedValues(QtObservedAtom::MAX_ObservedTypes)
[65c323]108{
[d48a16]109 boost::function<void ()> atomSubjectKilled(
[62a0ee]110 boost::bind(&QtObservedAtom::countValuesSubjectKilled,
111 boost::ref(*this),
[ee3fb8]112 boost::bind(&QtObservedAtom::getIndex, boost::ref(*this))));
[62a0ee]113 initObservedValues( ObservedValues, _id, _atom, atomSubjectKilled);
114
115 // activating Observer is done by ObservedValueContainer when it's inserted
[65c323]116}
[0070aa]117
118QtObservedAtom::~QtObservedAtom()
[65c323]119{
[ee3fb8]120 boost::any_cast<ObservedValue_wCallback<atomId_t, ObservedValue_Index_t> *>(ObservedValues[AtomIndex])->noteCallBackIsGone();
121 boost::any_cast<ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t> *>(ObservedValues[AtomBonds])->noteCallBackIsGone();
122 boost::any_cast<ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t> *>(ObservedValues[AtomElement])->noteCallBackIsGone();
[273c8a]123 boost::any_cast<ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t> *>(ObservedValues[MoleculeRef])->noteCallBackIsGone();
[ee3fb8]124 boost::any_cast<ObservedValue_wCallback<std::string, ObservedValue_Index_t> *>(ObservedValues[AtomName])->noteCallBackIsGone();
125 boost::any_cast<ObservedValue_wCallback<Vector, ObservedValue_Index_t> *>(ObservedValues[AtomPosition])->noteCallBackIsGone();
126 boost::any_cast<ObservedValue_wCallback<bool, ObservedValue_Index_t> *>(ObservedValues[AtomSelected])->noteCallBackIsGone();
[04c3a3]127
[65c323]128 deactivateObserver();
[c44763]129
130 destroyObservedValues(ObservedValues);
[65c323]131}
132
133const atom * const QtObservedAtom::getAtomConst(const atomId_t _id)
134{
135 const atom * const _atom = const_cast<const World &>(World::getInstance()).
136 getAtom(AtomById(_id));
137 return _atom;
138}
139
140atom * const QtObservedAtom::getAtom(const atomId_t _id)
141{
142 atom * const _atom = World::getInstance().getAtom(AtomById(_id));
143 return _atom;
144}
145
[f35f7e]146#ifdef HAVE_INLINE
147inline
148#endif
149atomId_t QtObservedAtom::updateIndex(const atom &_atomref)
[65c323]150{
[f35f7e]151 return _atomref.getId();
[65c323]152}
153
[fe493f]154QtObservedAtom::ListOfBonds_t QtObservedAtom::updateBonds(
[f35f7e]155 const atom &_atom)
[65c323]156{
[fe493f]157 ListOfBonds_t ListOfBonds;
[f35f7e]158 // make sure bonds is up-to-date
159 const BondList ListBonds = _atom.getListOfBonds();
160 for (BondList::const_iterator iter = ListBonds.begin();
161 iter != ListBonds.end();
162 ++iter)
163 ListOfBonds.insert( ListOfBonds.end(), std::make_pair(
164 (*iter)->leftatom->getId(),
165 (*iter)->rightatom->getId()) );
[fe493f]166 return ListOfBonds;
[65c323]167}
168
[f35f7e]169#ifdef HAVE_INLINE
170inline
171#endif
[65c323]172atomicNumber_t QtObservedAtom::updateElement(
[f35f7e]173 const atom &_atom)
[65c323]174{
[f35f7e]175 return _atom.getElementNo();
[65c323]176}
177
[f35f7e]178#ifdef HAVE_INLINE
179inline
180#endif
[273c8a]181QtObservedMolecule* QtObservedAtom::updateMoleculeRef(
[f35f7e]182 const atom &_atom)
[fe493f]183{
[f35f7e]184 if (_atom.getMolecule() != NULL) {
185 const moleculeId_t molid = _atom.getMolecule()->getId();
[273c8a]186 const QtObservedMolecule::ptr mol = board.getObservedMolecule(molid);
187 ASSERT(mol,
188 "QtObservedAtom::updateMoleculeRef() - could not update the ref, "
189 +toString(molid)+" unknown to Instance board?");
190 return mol.get();
[fe493f]191 } else {
[273c8a]192 return (QtObservedMolecule*)NULL;
[fe493f]193 }
194}
195
[f35f7e]196#ifdef HAVE_INLINE
197inline
198#endif
[fe493f]199std::string QtObservedAtom::updateName(
[f35f7e]200 const atom &_atom)
[65c323]201{
[f35f7e]202 return _atom.getName();
[fe493f]203}
204
[f35f7e]205#ifdef HAVE_INLINE
206inline
207#endif
[fe493f]208Vector QtObservedAtom::updatePosition(
[f35f7e]209 const atom &_atom)
[fe493f]210{
[f35f7e]211 return _atom.getPosition();
[65c323]212}
[98c35c]213
[f35f7e]214#ifdef HAVE_INLINE
215inline
216#endif
[9e9100]217bool QtObservedAtom::updateSelected(
[f35f7e]218 const atom &_atom)
[9e9100]219{
[f35f7e]220 return _atom.getSelected();
[9e9100]221}
222
[98c35c]223void QtObservedAtom::update(Observable *publisher)
[65c323]224{
225 ASSERT(0, "QtObservedAtom::update() - we are not signed on for global updates.");
226}
[98c35c]227
228void QtObservedAtom::subjectKilled(Observable *publisher)
[65c323]229{
230 ++signedOffChannels;
231
[ee3fb8]232 checkForRemoval(getIndex());
[62a0ee]233}
234
[ee3fb8]235void QtObservedAtom::countValuesSubjectKilled(ObservedValue_Index_t _id)
[62a0ee]236{
[ee3fb8]237 ASSERT( _id == getIndex(),
238 "QtObservedAtom::countValuesSubjectKilled() - atom "+toString(getIndex())
[62a0ee]239 +" received countValuesSubjectKilled for atom id "+toString(_id)+".");
240
241 ++subjectKilledCount;
242
[ee3fb8]243 checkForRemoval(_id);
[62a0ee]244}
245
246#ifdef HAVE_INLINE
247inline
248#endif
[ee3fb8]249void QtObservedAtom::checkForRemoval(ObservedValue_Index_t _id)
[62a0ee]250{
251 if ((signedOffChannels == AllsignedOnChannels) && (subjectKilledCount == MAX_ObservedTypes)) {
[65c323]252 // remove owner: no more signOff needed
253 owner = NULL;
254
[fe493f]255 emit atomRemoved();
[4e6ffe]256
257 if (!BoardIsGone) {
[ee3fb8]258 board.markObservedAtomAsDisconnected(_id);
259 board.markObservedAtomForErase(_id);
[4e6ffe]260 }
[65c323]261 }
262}
[98c35c]263
264void QtObservedAtom::recieveNotification(Observable *publisher, Notification_ptr notification)
[65c323]265{
266 // ObservedValues have been updated before, hence convert updates to Qt's signals
[4dfe724]267 if (publisher == WorldTime::getPointer()) {
268 // force update of all changes that may occur from one time step to another
269 boost::any_cast<ObservedValue_wCallback<Vector, ObservedValue_Index_t> *>(
270 ObservedValues[AtomPosition])->forceUpdate();
271 boost::any_cast<ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t> *>(
272 ObservedValues[MoleculeRef])->forceUpdate();
273 // then tell Qt part about updates
274 emit positionChanged();
275 emit moleculeChanged();
276 } else {
277 switch (notification->getChannelNo()) {
278 case AtomObservable::IndexChanged:
279 {
280 emit indexChanged();
281 break;
282 }
283 case AtomObservable::BondsAdded:
284 case AtomObservable::BondsRemoved:
285 emit bondsChanged();
286 break;
287 case AtomObservable::ElementChanged:
288 emit elementChanged();
289 break;
290 case AtomObservable::MoleculeChanged:
291 emit moleculeChanged();
292 break;
293 case AtomObservable::NameChanged:
294 emit nameChanged();
295 break;
296 case AtomObservable::PositionChanged:
297 emit positionChanged();
298 break;
299 case AtomObservable::SelectionChanged:
300 emit selectedChanged();
301 break;
302 default:
303 ASSERT(0, "QtObservedAtom::recieveNotification() - we are not signed on to channel "
304 +toString(notification->getChannelNo())+" of the atom.");
305 break;
[1c0961]306 }
[65c323]307 }
308}
309
310void QtObservedAtom::activateObserver()
311{
312 atom * atomref = getAtom(getAtomIndex());
313 if (atomref != NULL) {
314 Observable::channels_t channels = getAllObservedChannels();
315 owner = static_cast<const Observable *>(atomref);
316 for (Observable::channels_t::const_iterator iter = channels.begin();
317 iter != channels.end(); ++iter)
318 owner->signOn(this, *iter);
[04c3a3]319 if (!BoardIsGone)
[59eabc]320 board.markObservedAtomAsConnected(getIndex());
[65c323]321 } else
[04c3a3]322 signedOffChannels = AllsignedOnChannels;
[4dfe724]323
324 WorldTime::getInstance().signOn(this, WorldTime::TimeChanged);
[65c323]325}
326
327void QtObservedAtom::deactivateObserver()
328{
329 // sign Off
330 if (owner != NULL) {
331 Observable::channels_t channels = getAllObservedChannels();
332 for (Observable::channels_t::const_iterator iter = channels.begin();
333 iter != channels.end(); ++iter)
334 owner->signOff(this, *iter);
335 owner = NULL;
336 signedOffChannels = AllsignedOnChannels;
[04c3a3]337 if (!BoardIsGone)
[59eabc]338 board.markObservedAtomAsDisconnected(getIndex());
[65c323]339 }
[4dfe724]340
341 WorldTime::getInstance().signOff(this, WorldTime::TimeChanged);
[65c323]342}
343
344void QtObservedAtom::initObservedValues(
345 ObservedValues_t &_ObservedValues,
346 const atomId_t _id,
347 const atom * const _atomref,
[d48a16]348 const boost::function<void()> &_subjectKilled)
[65c323]349{
350 ASSERT( _ObservedValues.size() == MAX_ObservedTypes,
351 "QtObservedAtom::initObservedValues() - given ObservedValues has not correct size.");
352
353 // fill ObservedValues: then all the other that need index
[ee3fb8]354 const boost::function<atomId_t ()> AtomIndexUpdater(
355 boost::bind(&QtObservedAtom::updateIndex, boost::cref(*_atomref)));
[65c323]356 const boost::function<ListOfBonds_t ()> AtomBondsUpdater(
[f35f7e]357 boost::bind(&QtObservedAtom::updateBonds, boost::cref(*_atomref)));
[fe493f]358 const boost::function<atomicNumber_t ()> AtomElementUpdater(
[f35f7e]359 boost::bind(&QtObservedAtom::updateElement, boost::cref(*_atomref)));
[fe493f]360 const boost::function<std::string ()> AtomNameUpdater(
[f35f7e]361 boost::bind(&QtObservedAtom::updateName, boost::cref(*_atomref)));
[fe493f]362 const boost::function<Vector ()> AtomPositionUpdater(
[f35f7e]363 boost::bind(&QtObservedAtom::updatePosition, boost::cref(*_atomref)));
[9e9100]364 const boost::function<bool ()> AtomSelectedUpdater(
[f35f7e]365 boost::bind(&QtObservedAtom::updateSelected, boost::cref(*_atomref)));
[273c8a]366 const boost::function<QtObservedMolecule* ()> MoleculeRefUpdater(
367 boost::bind(&QtObservedAtom::updateMoleculeRef, this, boost::cref(*_atomref)));
[65c323]368
[ee3fb8]369 _ObservedValues[AtomIndex] = new ObservedValue_wCallback<atomId_t, ObservedValue_Index_t>(
370 _atomref,
371 AtomIndexUpdater,
372 "AtomIndex_"+toString(_id),
373 _id,
374 AtomIndexChannels,
[d48a16]375 _subjectKilled);
[ee3fb8]376 _ObservedValues[AtomBonds] = new ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t>(
[65c323]377 _atomref,
[fe493f]378 AtomBondsUpdater,
379 "AtomBonds_"+toString(_id),
380 AtomBondsUpdater(),
381 AtomBondsChannels,
[d48a16]382 _subjectKilled);
[ee3fb8]383 _ObservedValues[AtomElement] = new ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t>(
[65c323]384 _atomref,
385 AtomElementUpdater,
386 "AtomElement"+toString(_id),
387 AtomElementUpdater(),
388 AtomElementChannels,
[d48a16]389 _subjectKilled);
[ee3fb8]390 _ObservedValues[AtomName] = new ObservedValue_wCallback<std::string, ObservedValue_Index_t>(
[fe493f]391 _atomref,
392 AtomNameUpdater,
393 "AtomName"+toString(_id),
394 AtomNameUpdater(),
395 AtomNameChannels,
[d48a16]396 _subjectKilled);
[ee3fb8]397 _ObservedValues[AtomPosition] = new ObservedValue_wCallback<Vector, ObservedValue_Index_t>(
[fe493f]398 _atomref,
399 AtomPositionUpdater,
400 "AtomPosition_"+toString(_id),
401 AtomPositionUpdater(),
402 AtomPositionChannels,
[d48a16]403 _subjectKilled);
[ee3fb8]404 _ObservedValues[AtomSelected] = new ObservedValue_wCallback<bool, ObservedValue_Index_t>(
[9e9100]405 _atomref,
406 AtomSelectedUpdater,
407 "AtomSelected_"+toString(_id),
408 AtomSelectedUpdater(),
409 AtomSelectedChannels,
[d48a16]410 _subjectKilled);
[273c8a]411 _ObservedValues[MoleculeRef] = new ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t>(
412 _atomref,
413 MoleculeRefUpdater,
414 "AtomMoleculeIndex"+toString(_id),
415 MoleculeRefUpdater(),
416 MoleculeChangedChannels,
417 _subjectKilled);
[65c323]418}
419
420void QtObservedAtom::destroyObservedValues(
421 std::vector<boost::any> &_ObservedValues)
422{
[ee3fb8]423 delete boost::any_cast<ObservedValue_wCallback<atomId_t, ObservedValue_Index_t> *>(_ObservedValues[AtomIndex]);
424 delete boost::any_cast<ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t> *>(_ObservedValues[AtomBonds]);
425 delete boost::any_cast<ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t> *>(_ObservedValues[AtomElement]);
426 delete boost::any_cast<ObservedValue_wCallback<std::string, ObservedValue_Index_t> *>(_ObservedValues[AtomName]);
427 delete boost::any_cast<ObservedValue_wCallback<Vector, ObservedValue_Index_t> *>(_ObservedValues[AtomPosition]);
428 delete boost::any_cast<ObservedValue_wCallback<bool, ObservedValue_Index_t> *>(_ObservedValues[AtomSelected]);
[273c8a]429 delete boost::any_cast<ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t> *>(_ObservedValues[MoleculeRef]);
[65c323]430 _ObservedValues.clear();
431}
432
[59eabc]433ObservedValue_Index_t QtObservedAtom::getIndex() const
434{
[498c678]435 ASSERT( index != NULL,
[59eabc]436 "QtObservedAtom::getIndex() - index is NULL");
[498c678]437 return index;
[59eabc]438}
439
[3b9aa1]440const atomId_t& QtObservedAtom::getAtomIndex() const
[65c323]441{
[ee3fb8]442 return boost::any_cast<ObservedValue_wCallback<atomId_t, ObservedValue_Index_t> *>(ObservedValues[AtomIndex])->get();
[65c323]443}
444
[3b9aa1]445const QtObservedAtom::ListOfBonds_t& QtObservedAtom::getAtomBonds() const
[65c323]446{
[ee3fb8]447 return boost::any_cast<ObservedValue_wCallback<ListOfBonds_t, ObservedValue_Index_t> *>(ObservedValues[AtomBonds])->get();
[65c323]448}
449
[3b9aa1]450const atomicNumber_t& QtObservedAtom::getAtomElement() const
[65c323]451{
[ee3fb8]452 return boost::any_cast<ObservedValue_wCallback<atomicNumber_t, ObservedValue_Index_t> *>(ObservedValues[AtomElement])->get();
[65c323]453}
454
[3b9aa1]455const std::string& QtObservedAtom::getAtomName() const
[fe493f]456{
[ee3fb8]457 return boost::any_cast<ObservedValue_wCallback<std::string, ObservedValue_Index_t> *>(ObservedValues[AtomName])->get();
[fe493f]458}
459
[3b9aa1]460const Vector& QtObservedAtom::getAtomPosition() const
[fe493f]461{
[ee3fb8]462 return boost::any_cast<ObservedValue_wCallback<Vector, ObservedValue_Index_t> *>(ObservedValues[AtomPosition])->get();
[65c323]463}
[9e9100]464
465const bool QtObservedAtom::getAtomSelected() const
466{
[ee3fb8]467 return boost::any_cast<ObservedValue_wCallback<bool, ObservedValue_Index_t> *>(ObservedValues[AtomSelected])->get();
[9e9100]468}
[273c8a]469
470const QtObservedMolecule* const QtObservedAtom::getMoleculeRef() const
471{
472 return boost::any_cast<ObservedValue_wCallback<QtObservedMolecule*, ObservedValue_Index_t> *>(ObservedValues[MoleculeRef])->get();
473}
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