source: src/UIElements/TextUI/Query/RealSpaceMatrixTextQuery.cpp@ 852ea3

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
Last change on this file since 852ea3 was 852ea3, checked in by Michael Ankele <ankele@…>, 12 years ago

further query merging (QtQuery added, handle() won't use param.set())

  • Property mode set to 100644
File size: 1.4 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
8/*
9 * BoxTextQuery.cpp
10 *
11 * Created on: Oct 25, 2010
12 * Author: heber
13 */
14
15// include config.h
16#ifdef HAVE_CONFIG_H
17#include <config.h>
18#endif
19
20#include "CodePatterns/MemDebug.hpp"
21
22#include <iostream>
23
24#include "TextUI/Query/TextQuery.hpp"
25
26#include "CodePatterns/Log.hpp"
27#include "CodePatterns/Verbose.hpp"
28#include "LinearAlgebra/RealSpaceMatrix.hpp"
29
30
31TextDialog::RealSpaceMatrixTextQuery::RealSpaceMatrixTextQuery(Parameter<RealSpaceMatrix> &_param, std::string title, std::string _description) :
32 Dialog::TQuery<RealSpaceMatrix>(_param, title,_description)
33{}
34
35TextDialog::RealSpaceMatrixTextQuery::~RealSpaceMatrixTextQuery()
36{}
37
38bool TextDialog::RealSpaceMatrixTextQuery::handle() {
39 std::cout << getTitle();
40
41 double dtemp[6];
42 std::cout << getDescription() << " - ";
43 std::string coords[6] = {"xx","yx","yy", "zx", "zy", "zz"};
44 for (int i=0;i<6;i++) {
45 std::cout << coords[i] << ": ";
46 std::cin >> dtemp[i];
47 }
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 return true;
58}
59
Note: See TracBrowser for help on using the repository browser.