Action_Thermostats
Add_AtomRandomPerturbation
Add_SelectAtomByNameAction
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.1
ChangeBugEmailaddress
ChemicalSpaceEvaluator
Docu_Python_wait
EmpiricalPotential_contain_HomologyGraph_documentation
Enhance_userguide
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
Fix_StepWorldTime_single_argument
Fix_Verbose_Codepatterns
ForceAnnealing_oldresults
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
Gui_displays_atomic_force_velocity
IndependentFragmentGrids_IntegrationTest
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
PythonUI_with_named_parameters
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
StoppableMakroAction
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
|
Last change
on this file since 137845 was c015b3, checked in by Frederik Heber <heber@…>, 13 years ago |
|
Added enable-switches for Qt-based GUI and python module and scripts.
- note that encapsulation in AS_IF is absolutely required as otherwise
lateron checks will produce strange errors as required checks reside
in an unseen if ..; then branch, initiated by AC_PROG() ... or other
contained macros.
- Added AM_CONDITIIONAL's to modify Makefile.ams depending on above enable
switches.
- AM_COND_IF controls whether certain Makefile's are produced or not.
- moved Python regression tests into own folder to control whether they
are executed or not.
- molecuildergui and libMolecuilderQtUI are only compiled with qtgui
enabled.
- same for pyMoleCuilder and its scripts only when python enabled.
|
-
Property mode
set to
100644
|
|
File size:
432 bytes
|
| Line | |
|---|
| 1 | global: defaultpath="/home/heber/tmp/argon";
|
|---|
| 2 | global: projectname="argon";
|
|---|
| 3 | global: comment="Argon example";
|
|---|
| 4 | global: systemofunits=custom;
|
|---|
| 5 |
|
|---|
| 6 |
|
|---|
| 7 | custom: lengthunit=angstrom;
|
|---|
| 8 | custom: lengthscalingfactor=3.4;
|
|---|
| 9 | custom: timeunit=ps;
|
|---|
| 10 | custom: timescalingfactor=2.17;
|
|---|
| 11 | custom: massunit=u;
|
|---|
| 12 | custom: massscalingfactor=39.948;
|
|---|
| 13 | custom: currentunit="e/s";
|
|---|
| 14 | custom: currentscalingfactor=1;
|
|---|
| 15 | custom: temperatureunit=K;
|
|---|
| 16 | custom: temperaturescalingfactor=120;
|
|---|
Note:
See
TracBrowser
for help on using the repository browser.
