Changeset b10593 for tests/GuiChecks
- Timestamp:
- Jul 12, 2017, 7:11:51 PM (8 years ago)
- 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:
- 7516f6
- Parents:
- ecacf0
- git-author:
- Frederik Heber <frederik.heber@…> (07/07/17 13:22:34)
- git-committer:
- Frederik Heber <frederik.heber@…> (07/12/17 19:11:51)
- Location:
- tests/GuiChecks
- Files:
-
- 7 added
- 10 edited
Legend:
- Unmodified
- Added
- Removed
-
tests/GuiChecks/Atoms/testsuite-atoms.at
recacf0 rb10593 49 49 m4_include([Atoms/Saturate/testsuite-atoms-saturate-atoms-nitrogen.at]) 50 50 m4_include([Atoms/Saturate/testsuite-atoms-saturate-atoms-bonded_atoms.at]) 51 52 # mirror atoms 53 m4_include([Atoms/RandomPerturbation/testsuite-atoms-random-perturbation.at]) -
tests/GuiChecks/Fragmentation/ParseSaveFragmentResults/testsuite-fragmentation-parse-save-fragment-results.at
recacf0 rb10593 35 35 AT_CHECK([../../molecuilderguitest session-fragmentation-parse-save-fragment-results_new.py], 0, [ignore], [ignore]) 36 36 # we ignore white space changes (also missing new line on end of last line) 37 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_enabled.dat], 0, [ignore], [ignore], [38 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_disabled.dat], 0, [ignore], [ignore], [39 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_jobmarkt_disabled.dat], 0, [ignore], [ignore])37 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_enabled.dat], 0, [ignore], [ignore], [ 38 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_disabled.dat], 0, [ignore], [ignore], [ 39 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_jobmarkt_disabled.dat], 0, [ignore], [ignore]) 40 40 ]) 41 41 ]) … … 49 49 AT_CHECK([grep -v "Command.*DryRun" session-fragmentation-parse-save-fragment-results.py >session-fragmentation-parse-save-fragment-results_new.py], 0, [ignore], [ignore]) 50 50 AT_CHECK([../../molecuilderguitest session-fragmentation-parse-save-fragment-results_new.py], 0, [ignore], [ignore]) 51 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_enabled.dat], 0, [ignore], [ignore], [52 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_disabled.dat], 0, [ignore], [ignore], [53 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_jobmarkt_disabled.dat], 0, [ignore], [ignore])51 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_enabled.dat], 0, [ignore], [ignore], [ 52 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_disabled.dat], 0, [ignore], [ignore], [ 53 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_jobmarkt_disabled.dat], 0, [ignore], [ignore]) 54 54 ]) 55 55 ]) … … 67 67 AT_CHECK([../../molecuilderguitest session-fragmentation-parse-save-fragment-results_new.py], 0, [ignore], [ignore]) 68 68 # we ignore white space changes (also missing new line on end of last line) 69 AT_CHECK([ diff -Z$emptyfile ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_empty_longrange_enabled.dat], 0, [ignore], [ignore], [70 AT_CHECK([ diff -Z$emptyfile ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_empty_longrange_disabled.dat], 0, [ignore], [ignore], [71 AT_CHECK([ diff -Z$emptyfile ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_empty_jobmarkt_disabled.dat], 0, [ignore], [ignore])69 AT_CHECK([../../difffragmentresultcontainer $emptyfile ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_empty_longrange_enabled.dat], 0, [ignore], [ignore], [ 70 AT_CHECK([../../difffragmentresultcontainer $emptyfile ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_empty_longrange_disabled.dat], 0, [ignore], [ignore], [ 71 AT_CHECK([../../difffragmentresultcontainer $emptyfile ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_empty_jobmarkt_disabled.dat], 0, [ignore], [ignore]) 72 72 ]) 73 73 ]) … … 85 85 AT_CHECK([../../molecuilderguitest session-fragmentation-parse-save-fragment-results_new.py], 0, [ignore], [ignore]) 86 86 # we ignore white space changes (also missing new line on end of last line) 87 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_enabled.dat], 0, [ignore], [ignore], [88 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_disabled.dat], 0, [ignore], [ignore], [89 AT_CHECK([ diff -Z$file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_jobmarkt_disabled.dat], 0, [ignore], [ignore])87 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_enabled.dat], 0, [ignore], [ignore], [ 88 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_longrange_disabled.dat], 0, [ignore], [ignore], [ 89 AT_CHECK([../../difffragmentresultcontainer $file ${abs_top_srcdir}/tests/regression/Fragmentation/ParseSaveFragmentResults/post/results_jobmarkt_disabled.dat], 0, [ignore], [ignore]) 90 90 ]) 91 91 ]) -
tests/GuiChecks/Geometry/testsuite-geometry-common.at
recacf0 rb10593 21 21 AT_SETUP([Geometry - automatically added geometry names]) 22 22 AT_KEYWORDS([geometry]) 23 AT_CHECK([../../molecuilder --dry-run --input-to-vector "zeroVector" -- position"0,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore])23 AT_CHECK([../../molecuilder --dry-run --input-to-vector "zeroVector" --coordinates "0,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore]) 24 24 AT_CHECK([grep -v "Command.*DryRun" session-geometry-common.py >session-geometry-common_new.py], 0, [ignore], [ignore]) 25 25 AT_CHECK([../../molecuilderguitest session-geometry-common_new.py], 5, [ignore], [ignore]) 26 AT_CHECK([../../molecuilder --dry-run --input-to-vector "unitVectorX" -- position"1,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore])26 AT_CHECK([../../molecuilder --dry-run --input-to-vector "unitVectorX" --coordinates "1,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore]) 27 27 AT_CHECK([grep -v "Command.*DryRun" session-geometry-common.py >session-geometry-common_new.py], 0, [ignore], [ignore]) 28 28 AT_CHECK([../../molecuilderguitest session-geometry-common_new.py], 5, [ignore], [ignore]) 29 AT_CHECK([../../molecuilder --dry-run --input-to-vector "unitVectorY" -- position"0,1,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore])29 AT_CHECK([../../molecuilder --dry-run --input-to-vector "unitVectorY" --coordinates "0,1,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore]) 30 30 AT_CHECK([grep -v "Command.*DryRun" session-geometry-common.py >session-geometry-common_new.py], 0, [ignore], [ignore]) 31 31 AT_CHECK([../../molecuilderguitest session-geometry-common_new.py], 5, [ignore], [ignore]) 32 AT_CHECK([../../molecuilder --dry-run --input-to-vector "unitVectorZ" -- position"0,0,1" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore])32 AT_CHECK([../../molecuilder --dry-run --input-to-vector "unitVectorZ" --coordinates "0,0,1" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore]) 33 33 AT_CHECK([grep -v "Command.*DryRun" session-geometry-common.py >session-geometry-common_new.py], 0, [ignore], [ignore]) 34 34 AT_CHECK([../../molecuilderguitest session-geometry-common_new.py], 5, [ignore], [ignore]) … … 38 38 AT_SETUP([Geometry - illegal geometry names]) 39 39 AT_KEYWORDS([geometry]) 40 AT_CHECK([../../molecuilder --dry-run --input-to-vector "0,0,0" -- position"0,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore])40 AT_CHECK([../../molecuilder --dry-run --input-to-vector "0,0,0" --coordinates "0,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore]) 41 41 AT_CHECK([grep -v "Command.*DryRun" session-geometry-common.py >session-geometry-common_new.py], 0, [ignore], [ignore]) 42 42 AT_CHECK([../../molecuilderguitest session-geometry-common_new.py], 5, [ignore], [ignore]) 43 AT_CHECK([../../molecuilder --dry-run --input-to-vector "1" -- position"1,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore])43 AT_CHECK([../../molecuilder --dry-run --input-to-vector "1" --coordinates "1,0,0" --no-dry-run --store-session session-geometry-common.py --session-type python], 0, [ignore], [ignore]) 44 44 AT_CHECK([grep -v "Command.*DryRun" session-geometry-common.py >session-geometry-common_new.py], 0, [ignore], [ignore]) 45 45 AT_CHECK([../../molecuilderguitest session-geometry-common_new.py], 5, [ignore], [ignore]) -
tests/GuiChecks/Makefile.am
recacf0 rb10593 25 25 $(srcdir)/./Atoms/RemoveCuboid/testsuite-atoms-remove-cuboid.at \ 26 26 $(srcdir)/./Atoms/TranslationToOrigin/testsuite-atoms-translation-to-origin.at \ 27 $(srcdir)/./Atoms/RandomPerturbation/testsuite-atoms-random-perturbation.at \ 27 28 $(srcdir)/./Atoms/Saturate/testsuite-atoms-saturate-atoms-bonded_atoms.at \ 28 29 $(srcdir)/./Atoms/Saturate/testsuite-atoms-saturate-atoms-carbon.at \ … … 78 79 $(srcdir)/./Parser/Pdb/testsuite-parser-pdb-save.at \ 79 80 $(srcdir)/./Parser/Tremolo/testsuite-parser-tremolo-load.at \ 81 $(srcdir)/./Parser/Tremolo/testsuite-parser-tremolo-load-multiple-timesteps.at \ 80 82 $(srcdir)/./Parser/Tremolo/testsuite-parser-tremolo-load-multiply.at \ 81 83 $(srcdir)/./Parser/Tremolo/testsuite-parser-tremolo-save-unique_usedfields.at \ … … 105 107 $(srcdir)/./Domain/AddEmptyBoundary/testsuite-domain-add-empty-boundary.at \ 106 108 $(srcdir)/./Selection/Atoms/testsuite-selection-atoms.at \ 109 $(srcdir)/./Selection/Atoms/AtomByName/testsuite-selection-unselect-atoms-by-name.at \ 110 $(srcdir)/./Selection/Atoms/AtomByName/testsuite-selection-select-atoms-by-name.at \ 107 111 $(srcdir)/./Selection/Atoms/AtomById/testsuite-selection-unselect-atom-by-id.at \ 108 112 $(srcdir)/./Selection/Atoms/AtomById/testsuite-selection-select-atom-by-id.at \ … … 184 188 $(srcdir)/./Molecules/SaveTemperature/testsuite-molecules-save-temperature.at \ 185 189 $(srcdir)/./Molecules/RotateAroundSelf/testsuite-molecules-rotate-around-self.at \ 190 $(srcdir)/./Molecules/RotateAroundBond/testsuite-molecules-rotate-around-bond.at \ 186 191 $(srcdir)/./Molecules/SaveAdjacency/testsuite-molecules-save-adjacency.at \ 187 192 $(srcdir)/./Molecules/Translation-Periodic/testsuite-molecules-translation-periodic.at \ 188 193 $(srcdir)/./Molecules/VerletIntegration/testsuite-molecules-verlet-integration.at \ 189 194 $(srcdir)/./Molecules/Copy/testsuite-molecules-copy-molecule.at \ 195 $(srcdir)/./Molecules/StretchBond/testsuite-molecules-stretch-bond-cyclic_bond.at \ 190 196 $(srcdir)/./Molecules/StretchBond/testsuite-molecules-stretch-bond.at \ 191 197 $(srcdir)/./Molecules/RotateAroundOrigin/testsuite-molecules-rotate-around-origin.at \ … … 232 238 max_jobs = 8 233 239 234 guicheck: adjacencymatcher atlocal package.m4molecuilder molecuilderguitest trianglematcher $(TESTSUITE)240 guicheck: adjacencymatcher atlocal difffragmentresultcontainer molecuilder molecuilderguitest trianglematcher $(TESTSUITE) 235 241 nrjobs=; \ 236 242 for flag in $$MAKEFLAGS; do \ … … 242 248 $(SHELL) '$(TESTSUITE)' $$nrjobs AUTOTEST_PATH='$(abs_top_builddir)/src' $(TESTSUITEFLAGS) 243 249 244 installguicheck: adjacencymatcher atconfig atlocal molecuilder molecuilderguitest trianglematcher $(TESTSUITE)250 installguicheck: adjacencymatcher atconfig atlocal difffragmentresultcontainer molecuilder molecuilderguitest trianglematcher $(TESTSUITE) 245 251 nrjobs=; \ 246 252 for flag in $$MAKEFLAGS; do \ -
tests/GuiChecks/Molecules/RotateToPrincipalAxisSystem/testsuite-molecules-rotate-to-principal-axis-system.at
recacf0 rb10593 57 57 58 58 AT_SETUP([Molecules - Rotate to PAS with Undo]) 59 AT_XFAIL_IF([/bin/true])60 59 AT_KEYWORDS([molecules rotate-to-principal-axis-system undo]) 61 60 … … 96 95 97 96 AT_SETUP([Molecules - Rotate to PAS with Redo]) 98 AT_XFAIL_IF([/bin/true])99 97 AT_KEYWORDS([molecules rotate-to-principal-axis-system redo]) 100 98 -
tests/GuiChecks/Molecules/testsuite-molecules.at
recacf0 rb10593 60 60 m4_include([Molecules/RotateToPrincipalAxisSystem/testsuite-molecules-rotate-to-principal-axis-system.at]) 61 61 62 # rotate around one of its bond 63 m4_include([Molecules/RotateAroundBond/testsuite-molecules-rotate-around-bond.at]) 64 62 65 # Rotate around origin 63 66 m4_include([Molecules/RotateAroundOrigin/testsuite-molecules-rotate-around-origin.at]) … … 68 71 # stretch one of its bond 69 72 m4_include([Molecules/StretchBond/testsuite-molecules-stretch-bond.at]) 73 m4_include([Molecules/StretchBond/testsuite-molecules-stretch-bond-cyclic_bond.at]) 70 74 71 75 # anneal forces by one step -
tests/GuiChecks/Parser/testsuite-parser.at
recacf0 rb10593 66 66 m4_include([Parser/Tremolo/testsuite-parser-tremolo-improper.at]) 67 67 m4_include([Parser/Tremolo/testsuite-parser-tremolo-load.at]) 68 m4_include([Parser/Tremolo/testsuite-parser-tremolo-load-multiple-timesteps.at]) 68 69 m4_include([Parser/Tremolo/testsuite-parser-tremolo-load-multiply.at]) 69 70 m4_include([Parser/Tremolo/testsuite-parser-tremolo-save.at]) -
tests/GuiChecks/Selection/Atoms/testsuite-selection-atoms.at
recacf0 rb10593 38 38 m4_include(Selection/Atoms/AtomById/testsuite-selection-unselect-atom-by-id-multiple.at) 39 39 40 # (un)select atoms by name 41 m4_include(Selection/Atoms/AtomByName/testsuite-selection-select-atoms-by-name.at) 42 m4_include(Selection/Atoms/AtomByName/testsuite-selection-unselect-atoms-by-name.at) 43 40 44 # (un)select atom by order 41 45 m4_include(Selection/Atoms/AtomByOrder/testsuite-selection-select-atom-by-order.at) -
tests/GuiChecks/WorldTime/StepWorldTime/testsuite-worldtime-step-world-time.at
recacf0 rb10593 21 21 AT_KEYWORDS([worldtime step-world-time set-world-time]) 22 22 23 AT_CHECK([../../molecuilder --dry-run --step-world-time --steps-forward1 --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr])23 AT_CHECK([../../molecuilder --dry-run --step-world-time 1 --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr]) 24 24 AT_CHECK([grep -v "Command.*DryRun" session-worldtime-step-world-time.py >session-worldtime-step-world-time_new.py], 0, [ignore], [ignore]) 25 25 AT_CHECK([../../molecuilderguitest session-worldtime-step-world-time_new.py], 0, [stdout], [stderr]) 26 AT_CHECK([../../molecuilder --dry-run --set-world-time 4 --step-world-time - -steps-backward2 --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr])26 AT_CHECK([../../molecuilder --dry-run --set-world-time 4 --step-world-time -2 --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr]) 27 27 AT_CHECK([grep -v "Command.*DryRun" session-worldtime-step-world-time.py >session-worldtime-step-world-time_new.py], 0, [ignore], [ignore]) 28 28 AT_CHECK([../../molecuilderguitest session-worldtime-step-world-time_new.py], 0, [stdout], [stderr]) 29 29 # stepping back too far fails 30 AT_CHECK([../../molecuilder --dry-run --set-world-time 1 --step-world-time - -steps-backward2 --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr])30 AT_CHECK([../../molecuilder --dry-run --set-world-time 1 --step-world-time -2 --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr]) 31 31 AT_CHECK([grep -v "Command.*DryRun" session-worldtime-step-world-time.py >session-worldtime-step-world-time_new.py], 0, [ignore], [ignore]) 32 32 AT_CHECK([../../molecuilderguitest session-worldtime-step-world-time_new.py], 5, [stdout], [stderr]) … … 38 38 AT_KEYWORDS([worldtime step-world-time set-world-time undo]) 39 39 40 AT_CHECK([../../molecuilder --dry-run --set-world-time 2 --step-world-time - -steps-backward1 --undo --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr])40 AT_CHECK([../../molecuilder --dry-run --set-world-time 2 --step-world-time -1 --undo --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr]) 41 41 AT_CHECK([grep -v "Command.*DryRun" session-worldtime-step-world-time.py >session-worldtime-step-world-time_new.py], 0, [ignore], [ignore]) 42 42 AT_CHECK([../../molecuilderguitest session-worldtime-step-world-time_new.py], 0, [stdout], [stderr]) … … 47 47 AT_KEYWORDS([worldtime step-world-time set-world-time undo redo]) 48 48 49 AT_CHECK([../../molecuilder --dry-run --set-world-time 2 --step-world-time - -steps-backward1 --undo --redo --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr])49 AT_CHECK([../../molecuilder --dry-run --set-world-time 2 --step-world-time -1 --undo --redo --no-dry-run --store-session session-worldtime-step-world-time.py --session-type python], 0, [stdout], [stderr]) 50 50 AT_CHECK([grep -v "Command.*DryRun" session-worldtime-step-world-time.py >session-worldtime-step-world-time_new.py], 0, [ignore], [ignore]) 51 51 AT_CHECK([../../molecuilderguitest session-worldtime-step-world-time_new.py], 0, [stdout], [stderr]) -
tests/GuiChecks/atlocal.in
recacf0 rb10593 1 1 abs_top_srcdir='@abs_top_srcdir@' 2 topdir='@abs_top_builddir@' 2 3 valgrind='@VALGRIND@'
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