Ignore:
Timestamp:
Apr 4, 2018, 4:59:24 PM (7 years ago)
Author:
Frederik Heber <frederik.heber@…>
Branches:
Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.1, ChemicalSpaceEvaluator, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Exclude_Hydrogens_annealWithBondGraph, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_contraction-expansion, Gui_displays_atomic_force_velocity, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, PythonUI_with_named_parameters, StoppableMakroAction, TremoloParser_IncreasedPrecision
Children:
167523
Parents:
7e4d0a6
git-author:
Frederik Heber <frederik.heber@…> (07/12/17 21:01:31)
git-committer:
Frederik Heber <frederik.heber@…> (04/04/18 16:59:24)
Message:

TESTS: Added MD tests on methane, ethane, and water-filled system.

File:
1 edited

Legend:

Unmodified
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  • tests/integration/MolecularDynamics/testsuite-integration-moleculardynamics-water.at

    r7e4d0a6 r37fe17  
    1919
    2020# perform test with PoolWorkers using molecuilder_poolworker
    21 AT_SETUP([Integration - molecular dynamics of water])
    22 AT_KEYWORDS([molecular dynamics water])
     21AT_SETUP([Molecular Dynamics - water])
     22AT_KEYWORDS([molecular-dynamics water])
    2323
    2424# check that ports are unique over all tests such that they may run in parallel
    25 WORKERPORT=12110
    26 CONTROLLERPORT=12111
    27 WORKERLISTENPORT=12112
     25WORKERPORT=12130
     26CONTROLLERPORT=12131
     27WORKERLISTENPORT=12132
    2828
    2929# start service in background
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