- Timestamp:
- Feb 11, 2016, 8:06:49 AM (9 years ago)
- Branches:
- Action_Thermostats, Add_AtomRandomPerturbation, Add_FitFragmentPartialChargesAction, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Added_ParseSaveFragmentResults, AddingActions_SaveParseParticleParameters, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_ParticleName_to_Atom, Adding_StructOpt_integration_tests, AtomFragments, Automaking_mpqc_open, AutomationFragmentation_failures, Candidate_v1.5.4, Candidate_v1.6.0, Candidate_v1.6.1, ChangeBugEmailaddress, ChangingTestPorts, ChemicalSpaceEvaluator, CombiningParticlePotentialParsing, Combining_Subpackages, Debian_Package_split, Debian_package_split_molecuildergui_only, Disabling_MemDebug, Docu_Python_wait, EmpiricalPotential_contain_HomologyGraph, EmpiricalPotential_contain_HomologyGraph_documentation, Enable_parallel_make_install, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, FitPartialCharges_GlobalError, Fix_BoundInBox_CenterInBox_MoleculeActions, Fix_ChargeSampling_PBC, Fix_ChronosMutex, Fix_FitPartialCharges, Fix_FitPotential_needs_atomicnumbers, Fix_ForceAnnealing, Fix_IndependentFragmentGrids, Fix_ParseParticles, Fix_ParseParticles_split_forward_backward_Actions, Fix_PopActions, Fix_QtFragmentList_sorted_selection, Fix_Restrictedkeyset_FragmentMolecule, Fix_StatusMsg, Fix_StepWorldTime_single_argument, Fix_Verbose_Codepatterns, Fix_fitting_potentials, Fixes, ForceAnnealing_goodresults, ForceAnnealing_oldresults, ForceAnnealing_tocheck, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, FragmentAction_writes_AtomFragments, FragmentMolecule_checks_bonddegrees, GeometryObjects, Gui_Fixes, Gui_displays_atomic_force_velocity, ImplicitCharges, IndependentFragmentGrids, IndependentFragmentGrids_IndividualZeroInstances, IndependentFragmentGrids_IntegrationTest, IndependentFragmentGrids_Sole_NN_Calculation, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, JobMarket_unresolvable_hostname_fix, MoreRobust_FragmentAutomation, ODR_violation_mpqc_open, PartialCharges_OrthogonalSummation, PdbParser_setsAtomName, PythonUI_with_named_parameters, QtGui_reactivate_TimeChanged_changes, Recreated_GuiChecks, Rewrite_FitPartialCharges, RotateToPrincipalAxisSystem_UndoRedo, SaturateAtoms_findBestMatching, SaturateAtoms_singleDegree, StoppableMakroAction, Subpackage_CodePatterns, Subpackage_JobMarket, Subpackage_LinearAlgebra, Subpackage_levmar, Subpackage_mpqc_open, Subpackage_vmg, Switchable_LogView, ThirdParty_MPQC_rebuilt_buildsystem, TrajectoryDependenant_MaxOrder, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps, TremoloParser_setsAtomName, Ubuntu_1604_changes, stable
- Children:
- ada8df
- Parents:
- 5d8f4f
- git-author:
- Frederik Heber <heber@…> (12/29/15 14:23:09)
- git-committer:
- Frederik Heber <heber@…> (02/11/16 08:06:49)
- Location:
- src/Atom
- Files:
-
- 3 edited
Legend:
- Unmodified
- Added
- Removed
-
src/Atom/AtomObserver.cpp
r5d8f4f rd4ba3f 36 36 #include "CodePatterns/MemDebug.hpp" 37 37 38 #include "AtomObserver.hpp"38 #include <boost/assign.hpp> 39 39 40 40 #include "CodePatterns/Singleton_impl.hpp" 41 41 42 #include "Atom/atom.hpp"43 42 #include "Atom/atom_observable.hpp" 44 43 44 #include "AtomObserver.hpp" 45 45 46 /** Private constructor of class AtomObserver. 47 * 48 */ 49 AtomObserver::AtomObserver() : 50 Relay(std::string("AtomObserver")) 46 using namespace boost::assign; 47 48 static const Observable::channels_t getAtomChannels() 51 49 { 52 Channels *OurChannel = new Channels(); 53 Observable::insertNotificationChannel( std::make_pair(static_cast<Observable *>(this), OurChannel) ); 54 OurChannel->addChannel(AtomObservable::PositionChanged); 55 OurChannel->addChannel(AtomObservable::VelocityChanged); 56 OurChannel->addChannel(AtomObservable::ForceChanged); 57 OurChannel->addChannel(AtomObservable::MoleculeChanged); 58 OurChannel->addChannel(AtomObservable::NameChanged); 59 OurChannel->addChannel(AtomObservable::ElementChanged); 60 OurChannel->addChannel(AtomObservable::IndexChanged); 61 OurChannel->addChannel(AtomObservable::PropertyChanged); 62 OurChannel->addChannel(AtomObservable::BondsAdded); 63 OurChannel->addChannel(AtomObservable::BondsRemoved); 64 OurChannel->addChannel(AtomObservable::TrajectoryChanged); 65 OurChannel->addChannel(AtomObservable::SelectionChanged); 50 Observable::channels_t channels; 51 for (int i=0;i<AtomObservable::NotificationType_MAX; ++i) 52 channels += (enum AtomObservable::NotificationType)i; 53 return channels; 66 54 } 67 55 68 /** Private Destructor of class AtomObserver. 69 * 70 */ 71 AtomObserver::~AtomObserver()56 const Observable::channels_t AtomObserver::AtomChannels(getAtomChannels()); 57 58 AtomObserver::AtomObserver() : 59 EntityObserver<atom>(AtomChannels, std::string("AtomObserver")) 72 60 {} 73 61 74 /** Function to call when a new atom has been created.75 *76 * @param res77 */78 void AtomObserver::AtomInserted(atom *res)79 {80 res->signOn(this, AtomObservable::PositionChanged);81 res->signOn(this, AtomObservable::VelocityChanged);82 res->signOn(this, AtomObservable::ForceChanged);83 res->signOn(this, AtomObservable::MoleculeChanged);84 res->signOn(this, AtomObservable::NameChanged);85 res->signOn(this, AtomObservable::ElementChanged);86 res->signOn(this, AtomObservable::IndexChanged);87 res->signOn(this, AtomObservable::PropertyChanged);88 res->signOn(this, AtomObservable::BondsAdded);89 res->signOn(this, AtomObservable::BondsRemoved);90 res->signOn(this, AtomObservable::TrajectoryChanged);91 res->signOn(this, AtomObservable::SelectionChanged);92 }93 94 /** Function to call when an atom is about to get deleted.95 *96 * @param res97 */98 void AtomObserver::AtomRemoved(atom *res)99 {100 res->signOff(this, AtomObservable::PositionChanged);101 res->signOff(this, AtomObservable::VelocityChanged);102 res->signOff(this, AtomObservable::ForceChanged);103 res->signOff(this, AtomObservable::MoleculeChanged);104 res->signOff(this, AtomObservable::NameChanged);105 res->signOff(this, AtomObservable::ElementChanged);106 res->signOff(this, AtomObservable::IndexChanged);107 res->signOff(this, AtomObservable::PropertyChanged);108 res->signOff(this, AtomObservable::BondsAdded);109 res->signOff(this, AtomObservable::BondsRemoved);110 res->signOff(this, AtomObservable::TrajectoryChanged);111 res->signOff(this, AtomObservable::SelectionChanged);112 }113 114 62 CONSTRUCT_SINGLETON(AtomObserver) -
src/Atom/AtomObserver.hpp
r5d8f4f rd4ba3f 14 14 #endif 15 15 16 #include "CodePatterns/Observer/Relay.hpp"17 16 #include "CodePatterns/Singleton.hpp" 17 18 #include "EntityObserver.hpp" 18 19 19 20 class atom; … … 21 22 /** The AtomObserver is a central instance to all changes occuring within atoms. 22 23 * 23 * The intent is that if a class wants to know about changes in just _any_ atom, 24 * he may register singly to this class and not to each and every atom. This also 25 * keeps him updated in case of removed or added atoms. 26 * 27 * \warning AtomObserver must get purged \b after World as we do not keep an 28 * an internal list of all atoms. Hence, each atom must get destroyed while 29 * the AtomObserver instance is still intact or segfault will occur. 24 * It implements the templated EntityObserver class for atoms. 30 25 * 31 26 * \sa MoleculeObserver 32 27 */ 33 class AtomObserver : public Singleton< AtomObserver>, public Relay28 class AtomObserver : public Singleton< AtomObserver >, public EntityObserver<atom> 34 29 { 35 30 //!> grant Singleton access to cstor and dstor. 36 friend class Singleton< AtomObserver>;31 friend class Singleton< AtomObserver >; 37 32 38 //!> grant atom access 39 friend class atom; 40 public: 41 42 private: 43 void AtomInserted(atom *res); 44 void AtomRemoved(atom *res); 33 //!> list of all observed channels 34 static const Observable::channels_t AtomChannels; 45 35 46 36 // private constructor and destructor due to singleton 47 37 AtomObserver(); 48 virtual ~AtomObserver();49 38 }; 50 39 -
src/Atom/atom.cpp
r5d8f4f rd4ba3f 60 60 { 61 61 // note AtomObserver about inserted atom 62 AtomObserver::getInstance(). AtomInserted(this);62 AtomObserver::getInstance().Inserted(this); 63 63 } 64 64 … … 75 75 76 76 // note AtomObserver about inserted atom 77 AtomObserver::getInstance(). AtomInserted(this);77 AtomObserver::getInstance().Inserted(this); 78 78 }; 79 79 … … 95 95 removeFromMolecule(); 96 96 // note AtomObserver about removed atom 97 AtomObserver::getInstance(). AtomRemoved(this);97 AtomObserver::getInstance().Removed(this); 98 98 } 99 99
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