Action_Thermostats
        Adding_Graph_to_ChangeBondActions
        Adding_MD_integration_tests
        Adding_StructOpt_integration_tests
        AutomationFragmentation_failures
        Candidate_v1.6.1
        Candidate_v1.7.0
        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
        stable
      
      
        
          | Last change
 on this file since 6e5b8d was             004d5c, checked in by Frederik Heber <heber@…>, 13 years ago | 
        
          | 
Removed JobMarket as it is now in its own repository.
 added ax_jobmarket.m4.
added check to configure.ac
Removed libraries libJobMarket... in Makefile.am's, replaced by
JobMarket_..._LIBS.
changed some includes that now required JobMarket/ prefix.
 
Larger change to get JobMarket including its tests out of MoleCuilder:
 configure has new enable-switch for JobMarket. Only then, we tests for its
presence and usability (and also for boost::asio).
I do not know how to check for AM_CONDITIONAL or config.h values properly in
a shell. Hence, I moved all regression tests dealing with the JobMarket into
their own folder tests/JobMarket with depends on CONDJOBMARKET whether its
included or not, similar to tests/Python.
TESTFIX: regression tests moved to tests/JobMarket have their paths changed.
FragmentationAutomationAction is now conditionally compiled in as well.
some Makefile.am's changed because we now have JobMarket_CFLAGS and _LIBS
similar CodePatterns.
We use boost::preprocessor to add it dependently on HAVE_JOBMARKET to
src/Actions/GlobalListOfActions.
TESTFIX: The former required a small change to CodeChecks test
testsuite-globallistofactions_hpp as we can check no longer for the action
name within brackets there.
FIX: I removed some unnecessary includes (defs.hpp) from MPQCCommandJob...hpp
into the .cpp files.
 | 
        
          | 
              
Property                 mode
 set to                 100755 | 
        
          | File size:
            514 bytes | 
      
      
| Line |  | 
|---|
| 1 | #!/bin/sh | 
|---|
| 2 | # | 
|---|
| 3 | # wrapper for testing molecuilder | 
|---|
| 4 |  | 
|---|
| 5 | . ../../atlocal | 
|---|
| 6 |  | 
|---|
| 7 | if test ! -z ${valgrind} | 
|---|
| 8 | then | 
|---|
| 9 | G_SLICE=always-malloc G_DEBUG=gc-friendly \ | 
|---|
| 10 | libtool --mode=execute \ | 
|---|
| 11 | ${valgrind} -v \ | 
|---|
| 12 | --log-file=valgrind.log \ | 
|---|
| 13 | --xml=yes \ | 
|---|
| 14 | --xml-file=valgrind.err \ | 
|---|
| 15 | --time-stamp=yes \ | 
|---|
| 16 | --error-exitcode=255 \ | 
|---|
| 17 | --leak-check=full \ | 
|---|
| 18 | --leak-resolution=high \ | 
|---|
| 19 | --num-callers=20 \ | 
|---|
| 20 | --track-origins=yes \ | 
|---|
| 21 | --show-reachable=yes \ | 
|---|
| 22 | "${AUTOTEST_PATH}/molecuilder" \ | 
|---|
| 23 | ${1+"$@"} | 
|---|
| 24 | else | 
|---|
| 25 | "${AUTOTEST_PATH}/molecuilder" \ | 
|---|
| 26 | ${1+"$@"} | 
|---|
| 27 | fi | 
|---|
| 28 |  | 
|---|
| 29 | status=$? | 
|---|
| 30 |  | 
|---|
| 31 | exit $status | 
|---|
       
      
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