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
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1 | /*
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2 | * ActionTrait.hpp
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3 | *
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4 | * Created on: Oct 26, 2010
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5 | * Author: heber
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6 | */
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7 |
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8 | #ifndef ACTIONTRAIT_HPP_
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9 | #define ACTIONTRAIT_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 <iosfwd>
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17 | #include <map>
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18 |
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19 | #include "Actions/OptionTrait.hpp"
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20 |
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21 | namespace MoleCuilder {
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22 |
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23 | /** Interface for all ActionTrait.
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24 | * This class defines the interface, i.e. the common set of information that
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25 | * is stored in this traits for Action classes. It also defines a set of getter
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26 | * functions.
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27 | *
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28 | * Note that there are no setters. This is because the information is to be
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29 | * given in a specialized form of the templated class ActionTrait that derives
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30 | * from this interface.
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31 | *
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32 | */
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33 | class ActionTrait : public OptionTrait {
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34 | public:
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35 | ActionTrait(const ActionTrait &_Traits);
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36 | ActionTrait(const OptionTrait &_Traits, const std::string _MenuTitle = "", const int _MenuPosition = 0);
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37 | explicit ActionTrait(const std::string &_token);
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38 | virtual ~ActionTrait();
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39 |
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40 | typedef std::map< std::string, OptionTrait* > options_map;
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41 | typedef options_map::iterator options_iterator;
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42 | typedef options_map::const_iterator options_const_iterator;
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43 |
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44 | const std::string& getMenuName() const;
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45 | int getMenuPosition() const;
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46 |
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47 | // getter for its options
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48 | OptionTrait const &getOption(const std::string &token) const;
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49 |
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50 | bool hasOption(const std::string &token) const;
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51 | bool hasOptions() const;
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52 |
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53 | options_iterator getBeginIter();
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54 | options_iterator getEndIter();
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55 | options_const_iterator getBeginIter() const;
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56 | options_const_iterator getEndIter() const;
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57 |
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58 | protected:
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59 |
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60 | // internal information this trait contains
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61 | std::string MenuTitle;
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62 | int MenuPosition;
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63 | options_map Options;
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64 | };
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65 |
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66 | }
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67 |
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68 | std::ostream &operator<<(std::ostream &out, const MoleCuilder::ActionTrait &a);
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69 |
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70 | #endif /* ACTIONTRAIT_HPP_ */
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