source: @ f5dbea

Action_Thermostats Add_AtomRandomPerturbation Add_RotateAroundBondAction Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.6.0 Candidate_v1.6.1 Candidate_v1.7.0 Candidate_v1.7.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator 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_ChronosMutex Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion GeometryObjects Gui_displays_atomic_force_velocity IndependentFragmentGrids_IntegrationTest JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks RotateToPrincipalAxisSystem_UndoRedo StoppableMakroAction Subpackage_CodePatterns Subpackage_JobMarket Subpackage_LinearAlgebra Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg ThirdParty_MPQC_rebuilt_buildsystem TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps Ubuntu_1604_changes stable
Name Size Rev Age Author Last Change
build-aux bf4b9f   15 years FrederikHeber Moved LinearAlgebra from folder src/ into distinct sub-package. - …
data 7f39de   12 years FrederikHeber DISTFIX: molecuilder_logo.png is contained, not molecuildergui.png.
debian 097535   10 years FrederikHeber Added version to debian changelog.
doc 2d1280   10 years FrederikHeber Added BondSetDegreeAction for manipulating bond degrees.
LinearAlgebra 6d5280   12 years FrederikHeber FIX: Reduced verbosity noise from Line::getIntersection(). - removed …
m4 b61bd5   11 years FrederikHeber Fixed levmar m4 to use pkgconfig and locate. - we don't need to give …
src f5dbea   10 years FrederikHeber VERBOSE: Verbosity fix to PotentialFitPartialChargesAction::performCall().
tests 9c793c   10 years FrederikHeber All ..Potentials now return BindingModel instead of HomologyGraph, …
utils 2fe4a5   10 years FrederikHeber TESTFIX: Changed all parse-tremolo-potential calls to …
.gitignore 289 bytes ​ df765f   15 years FrederikHeber gitignore ignores new .autotools of eclipse.
AUTHORS 204 bytes ​ 9cd807   16 years FrederikHeber FIX: Other authors were missing again in AUTHORS (thx Ralf!). - …
bootstrap 419 bytes ​ bf4b9f   15 years FrederikHeber Moved LinearAlgebra from folder src/ into distinct sub-package. - …
ChangeLog 173 bytes ​ 6ac7ee   17 years FrederikHeber Merge branch 'ConcaveHull' of ../espack2 into ConcaveHull Conflicts: …
checkcommits.sh 4.4 KB ​ dcc228   15 years FrederikHeber Added script to check all commits in a given range externally. - i.e. …
configure.ac 17.1 KB ​ 4b5bd2   10 years FrederikHeber Set version to 1.5.4. - MoleCuilder library is now 17:0:0. - Codename …
COPYING 17.6 KB ​ 8e463e   16 years FrederikHeber FIX: COPYING AND README still had conflict markers (thx Ralf!).
INSTALL 15.2 KB ​ 013a1f1   16 years FrederikHeber config/*, INSTALL and COPYING have not been present in the repo.
libmolecuilder_config.h.in 0 bytes ​ 861874   16 years FrederikHeber libMolecuilderAction is now a shared lib via libtool. This is all …
LinearAlgebra-debug.pc.in 368 bytes ​ ba3539   11 years FrederikHeber Package CodePatterns is now called libcodepatterns. - updated m4 …
makeDebianPackage.sh 1.1 KB ​ 08d9df7   11 years FrederikHeber FIX: Rename codepatterns -> libcodepatterns. - updated …
Makefile.am 909 bytes ​ 66b092   11 years FrederikHeber Added debugging package molecuilder-dbg and source package …
MoleCuilder.pc.in 465 bytes ​ ba3539   11 years FrederikHeber Package CodePatterns is now called libcodepatterns. - updated m4 …
NEWS 0 bytes ​ c88cde   18 years FrederikHeber -initial commit -Minimum set of files needed from ESPACK SVN …
README 937 bytes ​ d2596b   14 years FrederikHeber Added XmlParser for parsing configurations for ScaFaCoS generic test …
test_all.sh 4.6 KB ​ 490038   16 years FrederikHeber added --with-valgrind switch to configure script. - if given, we use …
TestRunnerClient.cpp 11.8 KB ​ 88b400   16 years FrederikHeber converted #define's to enums, consts and typedefs [Meyers, "Effective …
TestRunnerClient.h 4.1 KB ​ 861874   16 years FrederikHeber libMolecuilderAction is now a shared lib via libtool. This is all …
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