Changeset bdaacd for src/Actions

Timestamp:

Jun 11, 2010, 10:45:06 AM (15 years ago)

Author:

Frederik Heber <heber@…>

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:

f821d6

Parents:

48c338

git-author:

Frederik Heber <heber@…> (06/10/10 16:46:07)

git-committer:

Frederik Heber <heber@…> (06/11/10 10:45:06)

Message:

Case 'M' is now handled by CommandLineUI.

Location:

src/Actions

Files:

• MapOfActions.cpp (modified) (1 diff)
• WorldAction/SetGaussianBasisAction.cpp (modified) (2 diffs)

src/Actions/MapOfActions.cpp

@@ -261 +261 @@
 //  generic.insert("save-temperature");
   generic.insert("scale-box");
-//  generic.insert("set-basis");
+  generic.insert("set-basis");
 //      generic.insert("subspace-dissect");
   generic.insert("suspend-in-water");

src/Actions/WorldAction/SetGaussianBasisAction.cpp

@@ -8 +8 @@
 #include "Actions/WorldAction/SetGaussianBasisAction.hpp"
 #include "config.hpp"
+#include "log.hpp"
+#include "verbose.hpp"
 #include "World.hpp"
 
@@ -30 +32 @@
 Action::state_ptr WorldSetGaussianBasisAction::performCall() {
   Dialog *dialog = UIFactory::getInstance().makeDialog();
-
-  dialog->queryString(NAME, &World::getInstance().getConfig()->basis, MapOfActions::getInstance().getDescription(NAME));
+  config *configuration = World::getInstance().getConfig();
+  dialog->queryString(NAME, &(configuration->basis), MapOfActions::getInstance().getDescription(NAME));
 
   if(dialog->display()) {
+    DoLog(1) && (Log() << Verbose(1) << "Setting MPQC basis to " << configuration->basis << "." << endl);
     delete dialog;
     return Action::success;