Changeset 4e0e08 for tests/Examples/Simple
- Timestamp:
- Mar 2, 2017, 10:26:58 PM (8 years ago)
- Branches:
- Action_Thermostats, Add_AtomRandomPerturbation, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.0, Candidate_v1.6.1, ChangeBugEmailaddress, ChangingTestPorts, ChemicalSpaceEvaluator, Combining_Subpackages, Debian_Package_split, Debian_package_split_molecuildergui_only, Disabling_MemDebug, Docu_Python_wait, EmpiricalPotential_contain_HomologyGraph_documentation, Enable_parallel_make_install, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, FitPartialCharges_GlobalError, Fix_ChronosMutex, Fix_StatusMsg, Fix_StepWorldTime_single_argument, Fix_Verbose_Codepatterns, ForceAnnealing_goodresults, ForceAnnealing_oldresults, ForceAnnealing_tocheck, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, GeometryObjects, Gui_displays_atomic_force_velocity, IndependentFragmentGrids_IntegrationTest, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, JobMarket_unresolvable_hostname_fix, PartialCharges_OrthogonalSummation, PythonUI_with_named_parameters, QtGui_reactivate_TimeChanged_changes, Recreated_GuiChecks, RotateToPrincipalAxisSystem_UndoRedo, StoppableMakroAction, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps, Ubuntu_1604_changes, stable
- Children:
- 1cde364
- Parents:
- d8a1ff
- git-author:
- Frederik Heber <heber@…> (03/02/17 13:53:14)
- git-committer:
- Frederik Heber <heber@…> (03/02/17 22:26:58)
- File:
-
- 1 edited
Legend:
- Unmodified
- Added
- Removed
-
tests/Examples/Simple/testsuite-examples-simple-h2o.at
rd8a1ff r4e0e08 27 27 28 28 # start service in background 29 ${AUTOTEST_PATH}/molecuilder_server -- signal 2 --workerport $WORKERPORT --controllerport $CONTROLLERPORT &29 ${AUTOTEST_PATH}/molecuilder_server --workerport $WORKERPORT --controllerport $CONTROLLERPORT & 30 30 server_pid=$! 31 31 AT_CHECK([sleep 2], 0, [ignore], [ignore], [kill $server_pid]) 32 32 33 33 # enlist a worker to work on jobs 34 ../../molecuilder_mpqc +v 5 ++s ignal 2 ++server 127.0.0.1:${WORKERPORT} ++hostname 127.0.0.1 ++listen $WORKERLISTENPORT &34 ../../molecuilder_mpqc +v 5 ++server 127.0.0.1:${WORKERPORT} ++hostname 127.0.0.1 ++listen $WORKERLISTENPORT & 35 35 worker_pid=$! 36 AT_CHECK([sleep 1], 0, [ignore], [ignore], [kill $ server_pid $worker_pid])36 AT_CHECK([sleep 1], 0, [ignore], [ignore], [kill $worker_pid $server_pid]) 37 37 38 38 # use molecuilder to add jobs, wait for their completion and obtain results … … 46 46 --server-address 127.0.0.1 \ 47 47 --server-port $CONTROLLERPORT \ 48 --DoLongrange 0], 0, [stdout], [ignore], [kill $ server_pid $worker_pid])49 AT_CHECK([fgrep "There are 1 fragments" stdout], 0, [ignore], [ignore], [kill $ server_pid $worker_pid])50 AT_CHECK([fgrep "Energy: -75.6976" stdout], 0, [ignore], [ignore], [kill $ server_pid $worker_pid])51 AT_CHECK([egrep 'Forces: .-4.64797e-16,1.53012e-17,0.0915748.; .-0.0764258,4.19204e-18,-0.0457874.; .0.0764258,-1.94932e-17,-0.0457874.' stdout], 0, [ignore], [ignore], [kill $ server_pid $worker_pid])48 --DoLongrange 0], 0, [stdout], [ignore], [kill $worker_pid $server_pid]) 49 AT_CHECK([fgrep "There are 1 fragments" stdout], 0, [ignore], [ignore], [kill $worker_pid $server_pid]) 50 AT_CHECK([fgrep "Energy: -75.6976" stdout], 0, [ignore], [ignore], [kill $worker_pid $server_pid]) 51 AT_CHECK([egrep 'Forces: .-4.64797e-16,1.53012e-17,0.0915748.; .-0.0764258,4.19204e-18,-0.0457874.; .0.0764258,-1.94932e-17,-0.0457874.' stdout], 0, [ignore], [ignore], [kill $worker_pid $server_pid]) 52 52 53 # removeall to remove workers, then shutdown for server itself 54 AT_CHECK([${AUTOTEST_PATH}/molecuilder_controller --server 127.0.0.1:$CONTROLLERPORT --command removeall], 0, [stdout], [ignore], [kill $server_pid $worker_pid]) 55 AT_CHECK([${AUTOTEST_PATH}/molecuilder_controller --server 127.0.0.1:$CONTROLLERPORT --command shutdown], 0, [stdout], [ignore], [kill $server_pid $worker_pid]) 53 # send removeall to server such that all workers shutdown 54 AT_CHECK([${AUTOTEST_PATH}/molecuilder_controller --server 127.0.0.1:$CONTROLLERPORT --command removeall], 0, [ignore], [ignore], [kill $worker_pid $server_pid]) 55 AT_CHECK([sleep 1], 0, [ignore], [ignore], [kill $worker_pid $server_pid]) 56 AT_CHECK([kill -s 0 $worker_pid], 1, [ignore], [ignore], [kill $server_pid]) 56 57 57 # check that server is truely down 58 AT_CHECK([sleep 1], 0, [ignore], [ignore], [kill $server_pid $worker_pid]) 59 AT_CHECK([kill $server_pid $worker_pid], 1, [ignore], [ignore]) 58 # shutdown for server 59 AT_CHECK([${AUTOTEST_PATH}/molecuilder_controller --server 127.0.0.1:$CONTROLLERPORT --command shutdown], 0, [stdout], [ignore], [kill $worker_pid $server_pid]) 60 AT_CHECK([sleep 1], 0, [ignore], [ignore], [kill $worker_pid $server_pid]) 61 AT_CHECK([kill -s 0 $server_pid], 1, [ignore], [ignore]) 60 62 61 63 AT_CLEANUP
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