source: tests/regression/Parser/Pdb@ 3fb9ab

Action_Thermostats Add_AtomRandomPerturbation Add_FitFragmentPartialChargesAction Add_RotateAroundBondAction Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.5.4 Candidate_v1.6.0 Candidate_v1.6.1 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_ChargeSampling_PBC Fix_ChronosMutex Fix_FitPartialCharges Fix_FitPotential_needs_atomicnumbers Fix_ForceAnnealing Fix_IndependentFragmentGrids Fix_ParseParticles Fix_ParseParticles_split_forward_backward_Actions 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_IndividualZeroInstances IndependentFragmentGrids_IntegrationTest IndependentFragmentGrids_Sole_NN_Calculation 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 TrajectoryDependenant_MaxOrder TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps Ubuntu_1604_changes stable
Name Size Rev Age Author Last Change
../
pre 3dfd9c   13 years FrederikHeber BUGFIX: PdbParser stumbles over CONECT because it reads …
post 3dfd9c   13 years FrederikHeber BUGFIX: PdbParser stumbles over CONECT because it reads …
testsuite-parser-pdb-with-conects.at 2.1 KB 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
testsuite-parser-pdb-save.at 1.1 KB 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
testsuite-parser-pdb-multiple-timesteps.at 3.0 KB 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
testsuite-parser-pdb-load.at 1.9 KB 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
testsuite-parser-pdb-load-various.at 1.5 KB 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
testsuite-parser-pdb-load-multiply.at 1.4 KB 066442   10 years FrederikHeber Added TranslateMolecule action. - added translate-molecule to …
testsuite-parser-pdb-empty.at 1013 bytes 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
testsuite-parser-pdb-CONECTs_empty_space.at 1.3 KB 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
testsuite-parser-pdb-capital_letters_element.at 1.3 KB 0d97b4   12 years FrederikHeber FIX: Disclaimer appeared twice in each testsuite. Second time removed.
  • Property mode set to 040000
Note: See TracBrowser for help on using the repository browser.