source: ThirdParty/mpqc_open/src/bin/mpqc@ 3b74fa

Action_Thermostats Adding_Graph_to_ChangeBondActions 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
Name Size Rev Age Author Last Change
../
sample a844d8   56 years (none)
validate 854a1e   8 years FrederikHeber Increased max_jobs to 8 for all testsuite's Makefiles.am. - running …
LIBS.h 547 bytes a844d8   56 years (none)
Makefile.am 4.3 KB fbf005   8 years FrederikHeber HUGE: Extracted libmolecuilder_mpqc that is now linked to poolworker. …
mpqc.cc 43.0 KB fbf005   8 years FrederikHeber HUGE: Extracted libmolecuilder_mpqc that is now linked to poolworker. …
mpqc.dox 622 bytes a844d8   56 years (none)
mpqc.h 2.5 KB fbf005   8 years FrederikHeber HUGE: Extracted libmolecuilder_mpqc that is now linked to poolworker. …
mpqc_extract.h 335 bytes fbf005   8 years FrederikHeber HUGE: Extracted libmolecuilder_mpqc that is now linked to poolworker. …
mpqc_extract_dummy.cc 1.2 KB fbf005   8 years FrederikHeber HUGE: Extracted libmolecuilder_mpqc that is now linked to poolworker. …
mpqc_main.cc 2.0 KB fbf005   8 years FrederikHeber HUGE: Extracted libmolecuilder_mpqc that is now linked to poolworker. …
mpqccomp.dox 179 bytes a844d8   56 years (none)
mpqcin.cc 17.4 KB a844d8   56 years (none)
mpqcin.h 3.6 KB a844d8   56 years (none)
mpqcinp.dox 586 bytes a844d8   56 years (none)
mpqclic.dox 275 bytes a844d8   56 years (none)
mpqcoo.dox 38.1 KB a844d8   56 years (none)
mpqcover.dox 703 bytes a844d8   56 years (none)
mpqcrun.dox 5.3 KB a844d8   56 years (none)
mpqcrun.in 18.5 KB a844d8   56 years (none)
mpqcrunning.dox 12.8 KB a844d8   56 years (none)
mpqcrunproc 992 bytes a844d8   56 years (none)
mpqcsimp.dox 8.1 KB a844d8   56 years (none)
mpqcval.dox 5.2 KB a844d8   56 years (none)
mpqcwar.dox 263 bytes a844d8   56 years (none)
parse.cc 43.3 KB a844d8   56 years (none)
parse.h 3.4 KB a844d8   56 years (none)
parse.yy 6.2 KB a844d8   56 years (none)
scan.cc 48.6 KB a844d8   56 years (none)
scan.ll 3.0 KB a844d8   56 years (none)
scdirlist.h 1.3 KB 5b2946   8 years FrederikHeber configure.ac working, mpqc compiles, linking fails.
version.h 27 bytes a844d8   56 years (none)
  • Property mode set to 040000
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