Action_Thermostats
Add_AtomRandomPerturbation
Add_RotateAroundBondAction
Add_SelectAtomByNameAction
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.1
Candidate_v1.7.0
ChangeBugEmailaddress
ChangingTestPorts
ChemicalSpaceEvaluator
Docu_Python_wait
EmpiricalPotential_contain_HomologyGraph_documentation
Enhance_userguide
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
Fix_ChronosMutex
Fix_StatusMsg
Fix_StepWorldTime_single_argument
Fix_Verbose_Codepatterns
ForceAnnealing_goodresults
ForceAnnealing_oldresults
ForceAnnealing_tocheck
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
GeometryObjects
Gui_displays_atomic_force_velocity
IndependentFragmentGrids_IntegrationTest
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
PythonUI_with_named_parameters
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
RotateToPrincipalAxisSystem_UndoRedo
StoppableMakroAction
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
Ubuntu_1604_changes
stable
|
Last change
on this file since ce254c was f6c19d, checked in by Frederik Heber <heber@…>, 12 years ago |
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InterfaceVMGDebugJob now also uses optionally open boundary (FAS instead of CS).
- VMGDebugGridJob has parameter OpenBoundaryConditions.
- VMGDebugGridFragmentController uses parameter when instantiating
VMGDebugGridJobs.
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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 | * InterfaceVMGDebugGridJob.hpp
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| 3 | *
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| 4 | * Created on: 31.08.2012
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| 5 | * Author: Frederik Heber
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| 6 | */
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| 7 |
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| 8 | #ifndef INTERFACEVMGDEBUGGRIDJOB_HPP_
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| 9 | #define INTERFACEVMGDEBUGGRIDJOB_HPP_
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| 10 |
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| 11 | #ifdef HAVE_CONFIG_H
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| 12 | #include <config.h>
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| 13 | #endif
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| 14 |
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| 15 | #include "base/interface.hpp"
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| 16 | #include "base/vector.hpp"
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| 17 |
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| 18 | namespace VMG
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| 19 | {
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| 20 | class Grid;
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| 21 | class Multigrid;
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| 22 | }
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| 23 |
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| 24 | #include "Fragmentation/Summation/SetValues/SamplingGrid.hpp"
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| 25 |
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| 26 | namespace VMGInterfaces
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| 27 | {
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| 28 |
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| 29 | /** This interface is only used to get the \a sampled_input into the VMG
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| 30 | * grid to make use of its vtk displayer for debugging purposes.
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| 31 | *
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| 32 | * See VMGDebugGridJob.
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| 33 | */
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| 34 | class InterfaceVMGDebugGridJob : public VMG::Interface
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| 35 | {
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| 36 | public:
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| 37 | InterfaceVMGDebugGridJob(
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| 38 | const SamplingGrid &_sampled_input,
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| 39 | VMG::Boundary boundary,
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| 40 | int levelMin,
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| 41 | int levelMax,
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| 42 | const VMG::Vector &box_begin,
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| 43 | vmg_float box_end,
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| 44 | const int& near_field_cells,
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| 45 | int coarseningSteps=9,
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| 46 | double alpha=1.6);
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| 47 |
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| 48 | ~InterfaceVMGDebugGridJob() {}
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| 49 |
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| 50 | void ImportRightHandSide(VMG::Multigrid& multigrid);
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| 51 | void ExportSolution(VMG::Grid& grid);
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| 52 |
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| 53 | private:
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| 54 | //!> sampled density on the grid as input
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| 55 | const SamplingGrid sampled_input;
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| 56 | //!> number of grid points per axis as \f$2^{\mathrm{level}}\f$
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| 57 | const int level;
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| 58 | };
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| 59 |
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| 60 | }
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| 61 |
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| 62 | #endif /* INTERFACEVMGDEBUGGRIDJOB_HPP_ */
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