source: src/UIElements/Dialog.cpp@ eb0d77

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 eb0d77 was 852ea3, checked in by Michael Ankele <ankele@…>, 13 years ago

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

  • Property mode set to 100644
File size: 6.3 KB
RevLine 
[bcf653]1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
[0aa122]4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
[bcf653]5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
[f5a86a]8/*
9 * Dialog.cpp
10 *
11 * Created on: Jan 5, 2010
12 * Author: crueger
13 */
14
[bf3817]15// include config.h
16#ifdef HAVE_CONFIG_H
17#include <config.h>
18#endif
19
[ad011c]20#include "CodePatterns/MemDebug.hpp"
[112b09]21
[5079a0]22#include "Dialog.hpp"
[f5a86a]23
[ad011c]24#include "CodePatterns/Log.hpp"
25#include "CodePatterns/Verbose.hpp"
[8df74d]26
[e45c1d]27#include "Parameters/ParameterExceptions.hpp"
28
[8df74d]29class Atom;
30class element;
[cca9ef]31class RealSpaceMatrix;
[8df74d]32class molecule;
33class Vector;
[2ededc2]34
[f5a86a]35using namespace std;
36
37Dialog::Dialog()
38{
39}
40
41Dialog::~Dialog()
42{
[45f5d6]43 list<Query*>::iterator iter;
44 for(iter=queries.begin();iter!=queries.end();iter++){
45 delete (*iter);
46 }
[f5a86a]47}
48
[45f5d6]49void Dialog::registerQuery(Query *query){
50 queries.push_back(query);
51}
[f5a86a]52
[45f5d6]53bool Dialog::display(){
[852ea3]54 handleAll();
[d3a5ea]55 if(checkAll()){
56 setAll();
57 return true;
58 }
59 else{
60 return false;
61 }
62}
63
[852ea3]64void Dialog::handleAll(){
[45f5d6]65 list<Query*>::iterator iter;
66 for(iter=queries.begin(); iter!=queries.end(); iter++){
[852ea3]67 try{
68 (*iter)->handle();
69 }catch(...){
70 // if any query fails (is canceled), we can end the handling process
71 ELOG(1, "The following query failed: " << (**iter).getTitle() << ".");
[e45c1d]72 break;
73 }
[852ea3]74 }
75}
76
77bool Dialog::checkAll(){
78 list<Query*>::iterator iter;
79 bool retval = true;
80 for(iter=queries.begin(); iter!=queries.end(); iter++){
81 retval &= (*iter)->isValid();
[45f5d6]82 // if any query fails (is canceled), we can end the handling process
[94d131]83 if(!retval) {
[47d041]84 ELOG(1, "The following query failed: " << (**iter).getTitle() << ".");
[45f5d6]85 break;
[94d131]86 }
[45f5d6]87 }
88 return retval;
[f5a86a]89}
90
[d3a5ea]91void Dialog::setAll(){
92 list<Query*>::iterator iter;
93 for(iter=queries.begin(); iter!=queries.end(); iter++) {
[e45c1d]94 try {
95 (*iter)->setResult();
96 } catch (ParameterException &e) {
97 if( const std::string *name=boost::get_error_info<ParameterName>(e) )
98 ELOG(1, "The following parameter value is not valid: " << *name << ".");
99 break;
100 }
[d3a5ea]101 }
102}
103
[c508ef5]104bool Dialog::hasQueries(){
105 return queries.size();
106}
107
[1c55b8]108/*template <> void Dialog::query<Dialog::EmptyType>(Parameter<Dialog::EmptyType> &param, const char *token, std::string description)
[9ee38b]109{
[1c55b8]110 queryEmpty(param, token, description);
111}*/
[9ee38b]112
[f10b0c]113template <> void Dialog::query<bool>(Parameter<bool> &param, const char *token, std::string description)
[9ee38b]114{
[f10b0c]115 queryBoolean(param, token, description);
[9ee38b]116}
117
[f10b0c]118template <> void Dialog::query<int>(Parameter<int> &param, const char *token, std::string description)
[9ee38b]119{
[f10b0c]120 queryInt(param, token, description);
[9ee38b]121}
122
[f10b0c]123template <> void Dialog::query< std::vector<int> >(Parameter<std::vector<int> > &param, const char *token, std::string description)
[9ee38b]124{
[f10b0c]125 queryInts(param, token, description);
[9ee38b]126}
127
[f10b0c]128template <> void Dialog::query<unsigned int>(Parameter<unsigned int> &param, const char *token, std::string description)
[838cd0]129{
[f10b0c]130 queryUnsignedInt(param, token, description);
[838cd0]131}
132
[f10b0c]133template <> void Dialog::query< std::vector<unsigned int> >(Parameter<std::vector<unsigned int> > &param, const char *token, std::string description)
[12948c]134{
[f10b0c]135 queryUnsignedInts(param, token, description);
[12948c]136}
137
[f10b0c]138template <> void Dialog::query<double>(Parameter<double> &param, const char *token, std::string description)
[9ee38b]139{
[f10b0c]140 queryDouble(param, token, description);
[9ee38b]141}
142
[f10b0c]143template <> void Dialog::query< std::vector<double> >(Parameter<std::vector<double> > &param, const char *token, std::string description)
[9ee38b]144{
[f10b0c]145 queryDoubles(param, token, description);
[9ee38b]146}
147
[f10b0c]148template <> void Dialog::query<std::string>(Parameter<std::string> &param, const char *token, std::string description)
[9ee38b]149{
[f10b0c]150 queryString(param, token, description);
[9ee38b]151}
152
[f10b0c]153template <> void Dialog::query< std::vector<std::string> >(Parameter<std::vector<std::string> > &param, const char *token, std::string description)
[9ee38b]154{
[f10b0c]155 queryStrings(param, token, description);
[9ee38b]156}
157
[f10b0c]158template <> void Dialog::query<const atom *>(Parameter<const atom *> &param, const char *token, std::string description)
[9ee38b]159{
[f10b0c]160 queryAtom(param, token, description);
[9ee38b]161}
162
[f10b0c]163template <> void Dialog::query< std::vector<const atom *> >(Parameter<std::vector<const atom *> > &param, const char *token, std::string description)
[9ee38b]164{
[f10b0c]165 queryAtoms(param, token, description);
[9ee38b]166}
167
[f10b0c]168template <> void Dialog::query<const molecule *>(Parameter<const molecule *> &param, const char *token, std::string description)
[9ee38b]169{
[f10b0c]170 queryMolecule(param, token, description);
[9ee38b]171}
172
[f10b0c]173template <> void Dialog::query< std::vector<const molecule *> >(Parameter<std::vector<const molecule *> > &param, const char *token, std::string description)
[9ee38b]174{
[f10b0c]175 queryMolecules(param, token, description);
[9ee38b]176}
177
[f10b0c]178template <> void Dialog::query<Vector>(Parameter<Vector> &param, const char *token, std::string description)
[9ee38b]179{
[9d5531]180 queryVector(param, token, description);
[9ee38b]181}
182
[f10b0c]183template <> void Dialog::query< std::vector<Vector> >(Parameter<std::vector<Vector> > &param, const char *token, std::string description)
[9ee38b]184{
[9d5531]185 queryVectors(param, token, description);
[72f611]186}
187
[7d9416]188template <> void Dialog::query<RealSpaceMatrix>(Parameter<RealSpaceMatrix> &param, const char *token, std::string description)
[9ee38b]189{
[7d9416]190 queryRealSpaceMatrix(param, token, description);
[9ee38b]191}
192
[f10b0c]193template <> void Dialog::query<const element *>(Parameter<const element *> &param, const char *token, std::string description)
[9ee38b]194{
[f10b0c]195 queryElement(param, token, description);
[9ee38b]196}
197
[f10b0c]198template <> void Dialog::query< std::vector<const element *> >(Parameter<std::vector<const element *> > &param, const char *token, std::string description)
[9ee38b]199{
[f10b0c]200 queryElements(param, token, description);
[9ee38b]201}
202
[f10b0c]203template <> void Dialog::query< boost::filesystem::path >(Parameter<boost::filesystem::path> &param, const char *token, std::string description)
[6f5dfe]204{
[f10b0c]205 queryFile(param, token, description);
[6f5dfe]206}
207
[bd81f9]208template <> void Dialog::query< std::vector<boost::filesystem::path> >(Parameter<std::vector< boost::filesystem::path> > &param, const char *token, std::string description)
[2c5765]209{
[bd81f9]210 queryFiles(param, token, description);
[2c5765]211}
212
[f10b0c]213template <> void Dialog::query< RandomNumberDistribution_Parameters >(Parameter<RandomNumberDistribution_Parameters> &param, const char *token, std::string description)
[0275ad]214{
[f10b0c]215 queryRandomNumberDistribution_Parameters(param, token, description);
[0275ad]216}
217
[8df74d]218/************************** Query Infrastructure ************************/
219/* ---> shifted to folder Query */
220/************************************************************************/
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