Changeset 024c65 for tests/GuiChecks/Selection
- Timestamp:
- Jul 28, 2015, 2:03:59 PM (9 years ago)
- Branches:
- 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
- Children:
- c56922
- Parents:
- 7a0456
- git-author:
- Frederik Heber <heber@…> (07/08/15 06:47:52)
- git-committer:
- Frederik Heber <heber@…> (07/28/15 14:03:59)
- Location:
- tests/GuiChecks/Selection/Atoms
- Files:
-
- 7 edited
-
AtomsInsideCuboid/testsuite-selection-select-atoms-inside-cuboid-with-defaults.at (modified) (3 diffs)
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AtomsInsideCuboid/testsuite-selection-select-atoms-inside-cuboid.at (modified) (3 diffs)
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AtomsInsideCuboid/testsuite-selection-unselect-atoms-inside-cuboid.at (modified) (3 diffs)
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AtomsInsideSphere/testsuite-selection-select-atoms-inside-sphere.at (modified) (3 diffs)
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AtomsInsideSphere/testsuite-selection-select-atoms-inside-tiny-sphere.at (modified) (3 diffs)
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AtomsInsideSphere/testsuite-selection-unselect-atoms-inside-sphere.at (modified) (3 diffs)
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AtomsInsideSphere/testsuite-selection-unselect-atoms-inside-tiny-sphere.at (modified) (3 diffs)
Legend:
- Unmodified
- Added
- Removed
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tests/GuiChecks/Selection/Atoms/AtomsInsideCuboid/testsuite-selection-select-atoms-inside-cuboid-with-defaults.at
r7a0456 r024c65 25 25 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 26 26 AT_CHECK([chmod u+w $file], 0) 27 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --select-shape-by-name "cube1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid-with-defaults.py --session-type python], 0, [stdout], [stderr])27 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --select-shape-by-name "cube1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid-with-defaults.py --session-type python], 0, [stdout], [stderr]) 28 28 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-cuboid-with-defaults.py >session-selection-select-atoms-inside-cuboid-with-defaults_new.py], 0, [ignore], [ignore]) 29 29 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-cuboid-with-defaults_new.py], 0, [stdout], [stderr]) … … 46 46 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 47 47 AT_CHECK([chmod u+w $file], 0) 48 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --select-shape-by-name "cube1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid-with-defaults.py --session-type python], 0, [stdout], [stderr])48 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --select-shape-by-name "cube1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid-with-defaults.py --session-type python], 0, [stdout], [stderr]) 49 49 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-cuboid-with-defaults.py >session-selection-select-atoms-inside-cuboid-with-defaults_new.py], 0, [ignore], [ignore]) 50 50 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-cuboid-with-defaults_new.py], 0, [stdout], [stderr]) … … 60 60 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 61 61 AT_CHECK([chmod u+w $file], 0) 62 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --select-shape-by-name "cube1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid-with-defaults.py --session-type python], 0, [stdout], [stderr])62 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --select-shape-by-name "cube1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid-with-defaults.py --session-type python], 0, [stdout], [stderr]) 63 63 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-cuboid-with-defaults.py >session-selection-select-atoms-inside-cuboid-with-defaults_new.py], 0, [ignore], [ignore]) 64 64 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-cuboid-with-defaults_new.py], 0, [stdout], [stderr]) -
tests/GuiChecks/Selection/Atoms/AtomsInsideCuboid/testsuite-selection-select-atoms-inside-cuboid.at
r7a0456 r024c65 24 24 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 25 25 AT_CHECK([chmod u+w $file], 0) 26 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr])26 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr]) 27 27 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-cuboid.py >session-selection-select-atoms-inside-cuboid_new.py], 0, [ignore], [ignore]) 28 28 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-cuboid_new.py], 0, [stdout], [stderr]) … … 45 45 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 46 46 AT_CHECK([chmod u+w $file], 0) 47 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr])47 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr]) 48 48 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-cuboid.py >session-selection-select-atoms-inside-cuboid_new.py], 0, [ignore], [ignore]) 49 49 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-cuboid_new.py], 0, [stdout], [stderr]) … … 59 59 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 60 60 AT_CHECK([chmod u+w $file], 0) 61 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr])61 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr]) 62 62 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-cuboid.py >session-selection-select-atoms-inside-cuboid_new.py], 0, [ignore], [ignore]) 63 63 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-cuboid_new.py], 0, [stdout], [stderr]) -
tests/GuiChecks/Selection/Atoms/AtomsInsideCuboid/testsuite-selection-unselect-atoms-inside-cuboid.at
r7a0456 r024c65 25 25 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 26 26 AT_CHECK([chmod u+w $file], 0) 27 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --unselect-atoms-inside-volume 0 -r --no-dry-run --store-session session-selection-unselect-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr])27 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --unselect-atoms-inside-volume 0 -r --no-dry-run --store-session session-selection-unselect-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr]) 28 28 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-cuboid.py >session-selection-unselect-atoms-inside-cuboid_new.py], 0, [ignore], [ignore]) 29 29 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-cuboid_new.py], 0, [stdout], [stderr]) … … 46 46 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 47 47 AT_CHECK([chmod u+w $file], 0) 48 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --unselect-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr])48 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --unselect-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr]) 49 49 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-cuboid.py >session-selection-unselect-atoms-inside-cuboid_new.py], 0, [ignore], [ignore]) 50 50 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-cuboid_new.py], 0, [stdout], [stderr]) … … 60 60 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideCuboid/pre/box.xyz $file], 0) 61 61 AT_CHECK([chmod u+w $file], 0) 62 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --unselect-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr])62 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "cube1" --shape-type "cube" --translation "0,0,0" --stretch "10, 10, 10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "cube1" --unselect-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-cuboid.py --session-type python], 0, [stdout], [stderr]) 63 63 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-cuboid.py >session-selection-unselect-atoms-inside-cuboid_new.py], 0, [ignore], [ignore]) 64 64 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-cuboid_new.py], 0, [stdout], [stderr]) -
tests/GuiChecks/Selection/Atoms/AtomsInsideSphere/testsuite-selection-select-atoms-inside-sphere.at
r7a0456 r024c65 24 24 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 25 25 AT_CHECK([chmod u+w $file], 0) 26 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10., 10., 10." --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr])26 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10., 10., 10." --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr]) 27 27 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-sphere.py >session-selection-select-atoms-inside-sphere_new.py], 0, [ignore], [ignore]) 28 28 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-sphere_new.py], 0, [stdout], [stderr]) … … 45 45 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 46 46 AT_CHECK([chmod u+w $file], 0) 47 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10., 10., 10." --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr])47 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10., 10., 10." --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr]) 48 48 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-sphere.py >session-selection-select-atoms-inside-sphere_new.py], 0, [ignore], [ignore]) 49 49 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-sphere_new.py], 0, [stdout], [stderr]) … … 59 59 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 60 60 AT_CHECK([chmod u+w $file], 0) 61 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10., 10., 10." --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr])61 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10., 10., 10." --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr]) 62 62 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-sphere.py >session-selection-select-atoms-inside-sphere_new.py], 0, [ignore], [ignore]) 63 63 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-sphere_new.py], 0, [stdout], [stderr]) -
tests/GuiChecks/Selection/Atoms/AtomsInsideSphere/testsuite-selection-select-atoms-inside-tiny-sphere.at
r7a0456 r024c65 24 24 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 25 25 AT_CHECK([chmod u+w $file], 0) 26 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr])26 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume -r --no-dry-run --store-session session-selection-select-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr]) 27 27 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-tiny-sphere.py >session-selection-select-atoms-inside-tiny-sphere_new.py], 0, [ignore], [ignore]) 28 28 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-tiny-sphere_new.py], 0, [stdout], [stderr]) … … 45 45 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 46 46 AT_CHECK([chmod u+w $file], 0) 47 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr])47 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-select-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr]) 48 48 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-tiny-sphere.py >session-selection-select-atoms-inside-tiny-sphere_new.py], 0, [ignore], [ignore]) 49 49 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-tiny-sphere_new.py], 0, [stdout], [stderr]) … … 59 59 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 60 60 AT_CHECK([chmod u+w $file], 0) 61 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr])61 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --select-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-select-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr]) 62 62 AT_CHECK([grep -v "Command.*DryRun" session-selection-select-atoms-inside-tiny-sphere.py >session-selection-select-atoms-inside-tiny-sphere_new.py], 0, [ignore], [ignore]) 63 63 AT_CHECK([../../molecuilderguitest session-selection-select-atoms-inside-tiny-sphere_new.py], 0, [stdout], [stderr]) -
tests/GuiChecks/Selection/Atoms/AtomsInsideSphere/testsuite-selection-unselect-atoms-inside-sphere.at
r7a0456 r024c65 25 25 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 26 26 AT_CHECK([chmod u+w $file], 0) 27 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10,10,10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume -r --no-dry-run --store-session session-selection-unselect-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr])27 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10,10,10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume -r --no-dry-run --store-session session-selection-unselect-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr]) 28 28 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-sphere.py >session-selection-unselect-atoms-inside-sphere_new.py], 0, [ignore], [ignore]) 29 29 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-sphere_new.py], 0, [stdout], [stderr]) … … 46 46 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 47 47 AT_CHECK([chmod u+w $file], 0) 48 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10,10,10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr])48 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10,10,10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr]) 49 49 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-sphere.py >session-selection-unselect-atoms-inside-sphere_new.py], 0, [ignore], [ignore]) 50 50 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-sphere_new.py], 0, [stdout], [stderr]) … … 60 60 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 61 61 AT_CHECK([chmod u+w $file], 0) 62 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10,10,10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr])62 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "10,10,10" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-sphere.py --session-type python], 0, [stdout], [stderr]) 63 63 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-sphere.py >session-selection-unselect-atoms-inside-sphere_new.py], 0, [ignore], [ignore]) 64 64 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-sphere_new.py], 0, [stdout], [stderr]) -
tests/GuiChecks/Selection/Atoms/AtomsInsideSphere/testsuite-selection-unselect-atoms-inside-tiny-sphere.at
r7a0456 r024c65 24 24 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 25 25 AT_CHECK([chmod u+w $file], 0) 26 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume -r --no-dry-run --store-session session-selection-unselect-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr])26 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume -r --no-dry-run --store-session session-selection-unselect-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr]) 27 27 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-tiny-sphere.py >session-selection-unselect-atoms-inside-tiny-sphere_new.py], 0, [ignore], [ignore]) 28 28 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-tiny-sphere_new.py], 0, [stdout], [stderr]) … … 45 45 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 46 46 AT_CHECK([chmod u+w $file], 0) 47 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr])47 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr]) 48 48 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-tiny-sphere.py >session-selection-unselect-atoms-inside-tiny-sphere_new.py], 0, [ignore], [ignore]) 49 49 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-tiny-sphere_new.py], 0, [stdout], [stderr]) … … 59 59 AT_CHECK([/bin/cp -f ${abs_top_srcdir}/tests/regression/Selection/Atoms/AtomsInsideSphere/pre/box.xyz $file], 0) 60 60 AT_CHECK([chmod u+w $file], 0) 61 AT_CHECK([../../molecuilder --dry-run -i $file -v 5--select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr])61 AT_CHECK([../../molecuilder --dry-run -i $file -v 2 --select-all-atoms --create-shape --shape-name "sphere1" --shape-type "sphere" --translation "10,10,10" --stretch "1.65, 1.65, 1.65" --angle-x 0. --angle-y 0. --angle-z 0. --select-shape-by-name "sphere1" --unselect-atoms-inside-volume --undo --redo -r --no-dry-run --store-session session-selection-unselect-atoms-inside-tiny-sphere.py --session-type python], 0, [stdout], [stderr]) 62 62 AT_CHECK([grep -v "Command.*DryRun" session-selection-unselect-atoms-inside-tiny-sphere.py >session-selection-unselect-atoms-inside-tiny-sphere_new.py], 0, [ignore], [ignore]) 63 63 AT_CHECK([../../molecuilderguitest session-selection-unselect-atoms-inside-tiny-sphere_new.py], 0, [stdout], [stderr])
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