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
Last change
on this file since e85bf2 was 5ab796, checked in by Frederik Heber <heber@…>, 13 years ago |
Added regression test on whether all options in the python module are known with a default value.
- i.e. options.dat is complete and contains a value for each required option in
Python/AllActions test.
- added a few missing options to options.dat (thx test).
|
-
Property mode
set to
100644
|
File size:
977 bytes
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Line | |
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1 | import pyMoleCuilder as mol
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2 | import re, os, sys
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3 |
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4 | cmds = filter(lambda s: (s[0] != '_') and (s[0:11] != "PythonType_"), dir(mol))
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5 |
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6 | # read options.dat
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7 |
|
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8 | Defaults = {}
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9 |
|
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10 | with open('options.dat') as f:
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11 | for line in f:
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12 | if len(line) > 0 and line[0] != '#':
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13 | key, value = line.split('\t', 1)
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14 | value = value[1:-2] # remove quotes
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15 |
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16 | Defaults[key] = value
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17 |
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18 | Allparams = []
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19 |
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20 | def CheckParameters(docstring):
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21 | result = 0
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22 | params = re.findall(r'\(str\)([-a-zA-Z]*)', docstring)
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23 |
|
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24 | for param in params:
|
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25 | if not param in Allparams:
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26 | Allparams.append(param)
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27 |
|
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28 | if not param in Defaults:
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29 | print >> sys.stderr, param # write missing default value to stderr
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30 | result = 1
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31 |
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32 | return result
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33 |
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34 | result = 0
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35 |
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36 | for cmd in cmds:
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37 | print "Checking on %s" % cmd
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38 | doc = eval('mol.%s.__doc__' % cmd)
|
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39 | if CheckParameters(doc) == 1:
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40 | result = 1
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41 |
|
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42 | sys.exit(result)
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