Changeset 4c6f0d for tests/GuiChecks/Fragmentation

Timestamp:

Jul 12, 2017, 7:12:43 PM (8 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

Action_Thermostats, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.1, ChemicalSpaceEvaluator, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Exclude_Hydrogens_annealWithBondGraph, Fix_Verbose_Codepatterns, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, Gui_displays_atomic_force_velocity, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, PythonUI_with_named_parameters, Recreated_GuiChecks, StoppableMakroAction, TremoloParser_IncreasedPrecision

Children:

3c9ac3

Parents:

7516f6

git-author:

Frederik Heber <frederik.heber@…> (07/12/17 13:20:58)

git-committer:

Frederik Heber <frederik.heber@…> (07/12/17 19:12:43)

Message:

FIX: server-port was invalid.

• now, we use empty string as param default to mimick old behavior.
• TESTFIX: FragmentationAutomation tests had wrong key-word and used files from FragmentMolecule pre/ folder.

File:

• tests/GuiChecks/Fragmentation/FragmentationAutomation/testsuite-fragmentation-fragmentation-automation.at (modified) (2 diffs)

tests/GuiChecks/Fragmentation/FragmentationAutomation/testsuite-fragmentation-fragmentation-automation.at

@@ -19 +19 @@
 
 AT_SETUP([Fragmentation Automation - Fragmentation fails correctly])
-AT_KEYWORDS([fragmentation automation fragment-molecule fragmentation-automation])
+AT_KEYWORDS([fragmentation automation fragment-molecule fragment-automation])
 
 file=test.conf
-AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Fragmentation/FragmentMolecule/pre/test.conf $file], 0)
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Fragmentation/FragmentationAutomation/pre/test.conf $file], 0)
 AT_CHECK([chmod u+w $file], 0, [ignore], [ignore])
 AT_CHECK([../../molecuilder --dry-run   -i $file        --subgraph-dissection   --verbose 1     --select-molecule-by-id 0       --select-molecules-atoms        --fragment-molecule BondFragment        --distance 1.55         --order 2       --fragment-automation   --fragment-executable /bin/false --no-dry-run --store-session session-fragmentation-fragmentation-automation.py --session-type python], 0, [stdout], [stderr])
@@ -31 +31 @@
 
 AT_SETUP([Fragmentation Automation - Fragmentation fails, more Actions still in queue])
-AT_KEYWORDS([fragmentation automation fragment-molecule fragmentation-automation])
+AT_KEYWORDS([fragmentation automation fragment-molecule fragment-automation])
 
 file=test.conf
-AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Fragmentation/FragmentMolecule/pre/test.conf $file], 0)
+AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Fragmentation/FragmentationAutomation/pre/test.conf $file], 0)
 AT_CHECK([chmod u+w $file], 0, [ignore], [ignore])
 AT_CHECK([../../molecuilder --dry-run   -i $file        --subgraph-dissection   --verbose 1     --select-molecule-by-id 0       --select-molecules-atoms        --fragment-molecule BondFragment        --distance 1.55         --order 2       --fragment-automation   --fragment-executable /bin/false        --analyse-fragment-results      --fragment-prefix $FILENAME     --fragment-resultfile ${FILENAME}_results.dat --no-dry-run --store-session session-fragmentation-fragmentation-automation.py --session-type python], 0, [stdout], [stderr])