- Timestamp:
- Jul 18, 2012, 2:02:13 PM (13 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:
- b3a54d
- Parents:
- 30cd0d
- git-author:
- Michael Ankele <ankele@…> (07/04/12 13:49:18)
- git-committer:
- Michael Ankele <ankele@…> (07/18/12 14:02:13)
- File:
-
- 1 edited
Legend:
- Unmodified
- Added
- Removed
-
src/UIElements/TextUI/Query/RealSpaceMatrixTextQuery.cpp
r30cd0d r9d5531 29 29 30 30 31 TextDialog::RealSpaceMatrixTextQuery::RealSpaceMatrixTextQuery(Parameter<RealSpaceMatrix> & param, std::string title, std::string _description) :32 Dialog::RealSpaceMatrixQuery( param, title,_description)31 TextDialog::RealSpaceMatrixTextQuery::RealSpaceMatrixTextQuery(Parameter<RealSpaceMatrix> &_param, std::string title, std::string _description) : 32 Dialog::RealSpaceMatrixQuery(_param, title,_description) 33 33 {} 34 34 … … 39 39 std::cout << getTitle(); 40 40 41 double temp[6];41 double dtemp[6]; 42 42 std::cout << getDescription() << " - "; 43 43 std::string coords[6] = {"xx","yx","yy", "zx", "zy", "zz"}; 44 44 for (int i=0;i<6;i++) { 45 45 std::cout << coords[i] << ": "; 46 std::cin >> temp[i];46 std::cin >> dtemp[i]; 47 47 } 48 RealSpaceMatrix M; 49 M.set(0,0, temp[0]); 50 M.set(0,1, temp[1]); 51 M.set(0,2, temp[2]); 52 M.set(1,0, temp[1]); 53 M.set(1,1, temp[3]); 54 M.set(1,2, temp[4]); 55 M.set(2,0, temp[2]); 56 M.set(2,1, temp[4]); 57 M.set(2,2, temp[5]); 58 tmp.set(M); 48 temp.set(0,0, dtemp[0]); 49 temp.set(0,1, dtemp[1]); 50 temp.set(0,2, dtemp[2]); 51 temp.set(1,0, dtemp[1]); 52 temp.set(1,1, dtemp[3]); 53 temp.set(1,2, dtemp[4]); 54 temp.set(2,0, dtemp[2]); 55 temp.set(2,1, dtemp[4]); 56 temp.set(2,2, dtemp[5]); 57 param.set(temp); 59 58 return true; 60 59 }
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