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
Candidate_v1.7.0
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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Last change
on this file since e09d67 was e09d67, checked in by Frederik Heber <heber@…>, 14 years ago |
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Added class DiscreteValue that contains enums.
- class has extensive unit test.
- this should replace enums in MpqcParser_Parameters.
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-
Property mode
set to
100644
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File size:
1.3 KB
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| 1 | /*
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| 2 | * DiscreteValue.hpp
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| 3 | *
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| 4 | * Created on: Sep 28, 2011
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| 5 | * Author: heber
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| 6 | */
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| 7 |
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| 8 | #ifndef DISCRETEVALUE_HPP_
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| 9 | #define DISCRETEVALUE_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 <string>
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| 17 | #include <vector>
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| 18 |
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| 19 | /** This class represents a discrete value.
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| 20 | *
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| 21 | */
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| 22 | template <class T>
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| 23 | class DiscreteValue
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| 24 | {
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| 25 | //!> unit test needs to have access to internal values
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| 26 | friend class DiscreteValueTest;
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| 27 | public:
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| 28 | DiscreteValue();
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| 29 | DiscreteValue(const std::vector<T> &_ValidValues);
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| 30 | virtual ~DiscreteValue();
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| 31 |
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| 32 | // functions for ValueInterface
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| 33 | bool isValid(const T &_value) const;
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| 34 |
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| 35 | // init functions
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| 36 | void appendValidValue(const T &_value);
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| 37 | const std::vector<T> &getValidValues() const;
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| 38 |
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| 39 | // getter and setter
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| 40 | void set(const T &_value);
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| 41 |
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| 42 | const T & get() const;
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| 43 |
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| 44 | const size_t getIndexOfValue() const { return value; }
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| 45 |
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| 46 | private:
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| 47 | const size_t findIndexOfValue(const T &_value) const;
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| 48 |
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| 49 | //!> Typedef for the vector of valid values.
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| 50 | typedef std::vector<T> ValidRange;
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| 51 |
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| 52 | //!> whether a value has been set or not
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| 53 | bool ValueSet;
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| 54 |
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| 55 | //!> we only store the index within the \a ValidValues for the value
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| 56 | size_t value;
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| 57 | //!> list of valid values
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| 58 | std::vector<T> ValidValues;
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| 59 | };
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| 60 |
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| 61 | #include "DiscreteValue_impl.hpp"
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| 62 |
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| 63 | #endif /* DISCRETEVALUE_HPP_ */
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