source: tests/regression/Options/Session/testsuite-options-load-session-python.at@ 066442

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 066442 was 415ddd, checked in by Frederik Heber <heber@…>, 11 years ago

ActionQueue now contains a run thread.

  • otherwise the progress bar of the QtMainWindow cannot be seen as waitForResults() takes up all of the executing thread.
  • added mutex for operations modifying the queue.
  • added ActionQueue::run() and ::stop(), used by friend stopQueue().
  • insertAction() now makes use of a tempqueue that is added to true queue during run() instead of calling the actions directly.
  • new stopQueue() in cleanUp.hpp is used by module_exit in pyMoleCuilder and in main() before saveAll().
  • cleanup: printTiming() requires now list of action tokens and added new stopAndPurgeQueue() to place waiting for Actions to end into extra function.
  • added ActionQueue::wait() which allows for synchronization in python scripts, is ignored in session python scripts. Otherwise we wait for ActionQueue's queue to empty during execution of load-session which hangs.
  • DOCU: added note to python documentation.
  • added waitQueue() also to purgeStaticInstances().
  • static UIFactory::isFactoryPresent() added that allows checking whether we have a UI or are executed within a python script (i.e. pyMoleCuilder).
  • DOCU: Extended docu on threads and who this affects python scripts.
  • TESTFIX: changed regression tests on storing python sessions.
  • Property mode set to 100644
File size: 3.5 KB
Line 
1#
2# MoleCuilder - creates and alters molecular systems
3# Copyright (C) 2008-2012 University of Bonn
4#
5# This program is free software: you can redistribute it and/or modify
6# it under the terms of the GNU General Public License as published by
7# the Free Software Foundation, either version 3 of the License, or
8# (at your option) any later version.
9#
10# This program is distributed in the hope that it will be useful,
11# but WITHOUT ANY WARRANTY; without even the implied warranty of
12# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
13# GNU General Public License for more details.
14#
15# You should have received a copy of the GNU General Public License
16# along with this program. If not, see <http://www.gnu.org/licenses/>.
17#
18### load session
19
20AT_SETUP([Standard Options - load session])
21AT_KEYWORDS([options python load-session])
22AT_TESTED([python diff grep])
23AT_SKIP_IF([../../molecuilder --help --actionname load-session; if test $? -eq 5; then /bin/true; else /bin/false; fi])
24
25# check that session is stored and can be executed when correctly prefixed
26file=test.py
27AT_CHECK([../../molecuilder --load-session ${abs_top_srcdir}/tests/regression/Options/Session/pre/$file --store-session $file --session-type "python"], 0, [ignore], [ignore])
28AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Options/Session/post/$file], 0, [ignore], [ignore])
29AT_CHECK([../../runpython ./$file], 0, [ignore], [ignore])
30
31AT_CLEANUP
32
33AT_SETUP([Standard Options - load complex session])
34AT_KEYWORDS([options python load-session])
35AT_TESTED([python diff grep])
36AT_SKIP_IF([../../molecuilder --help --actionname load-session; if test $? -eq 5; then /bin/true; else /bin/false; fi])
37
38# check that session is stored and can be executed when correctly prefixed
39file=complextest.py
40AT_CHECK([../../molecuilder --load-session ${abs_top_srcdir}/tests/regression/Options/Session/pre/$file --store-session $file --session-type "python"], 0, [ignore], [ignore])
41AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Options/Session/post/$file], 0, [ignore], [ignore])
42AT_CHECK([../../runpython ./$file], 0, [ignore], [ignore])
43
44AT_CLEANUP
45
46AT_SETUP([Standard Options - load complex session with waits])
47AT_KEYWORDS([options load-session wait])
48AT_TESTED([diff grep])
49AT_SKIP_IF([../../molecuilder --help --actionname load-session; if test $? -eq 5; then /bin/true; else /bin/false; fi])
50
51file=complexwait.py
52AT_CHECK([../../molecuilder --load-session ${abs_top_srcdir}/tests/regression/Options/Session/pre/$file], 0, [stdout], [ignore])
53AT_CHECK([grep "Setting verbosity from 1 to 2." stdout], 0, [ignore], [ignore])
54AT_CHECK([grep "wait1" stdout], 0, [ignore], [ignore])
55AT_CHECK([grep "wait2" stdout], 0, [ignore], [ignore])
56AT_CHECK([grep "wait3" stdout], 0, [ignore], [ignore])
57AT_CHECK([grep "wait4" stdout], 0, [ignore], [ignore])
58
59AT_CLEANUP
60
61AT_SETUP([Standard Options - run complex session with waits])
62AT_KEYWORDS([options python wait])
63AT_TESTED([python diff grep])
64AT_SKIP_IF([../../molecuilder --help --actionname load-session; if test $? -eq 5; then /bin/true; else /bin/false; fi])
65
66file=complexwait.py
67AT_CHECK([../../runpython ${abs_top_srcdir}/tests/regression/Options/Session/pre/$file], 0, [stdout], [ignore])
68AT_CHECK([grep "Verbosity remains unchanged at 2" stdout], 0, [ignore], [ignore])
69AT_CHECK([grep "wait1" stdout], 0, [ignore], [ignore])
70AT_CHECK([grep "wait2" stdout], 0, [ignore], [ignore])
71AT_CHECK([grep "wait3" stdout], 0, [ignore], [ignore])
72AT_CHECK([grep "wait4" stdout], 0, [ignore], [ignore])
73
74AT_CLEANUP
75
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