Action_Thermostats
Add_AtomRandomPerturbation
Add_FitFragmentPartialChargesAction
Add_RotateAroundBondAction
Add_SelectAtomByNameAction
Added_ParseSaveFragmentResults
AddingActions_SaveParseParticleParameters
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_ParticleName_to_Atom
Adding_StructOpt_integration_tests
AtomFragments
Automaking_mpqc_open
AutomationFragmentation_failures
Candidate_v1.5.4
Candidate_v1.6.0
Candidate_v1.6.1
ChangeBugEmailaddress
ChangingTestPorts
ChemicalSpaceEvaluator
CombiningParticlePotentialParsing
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_BoundInBox_CenterInBox_MoleculeActions
Fix_ChargeSampling_PBC
Fix_ChronosMutex
Fix_FitPartialCharges
Fix_FitPotential_needs_atomicnumbers
Fix_ForceAnnealing
Fix_IndependentFragmentGrids
Fix_ParseParticles
Fix_ParseParticles_split_forward_backward_Actions
Fix_PopActions
Fix_QtFragmentList_sorted_selection
Fix_Restrictedkeyset_FragmentMolecule
Fix_StatusMsg
Fix_StepWorldTime_single_argument
Fix_Verbose_Codepatterns
Fix_fitting_potentials
Fixes
ForceAnnealing_goodresults
ForceAnnealing_oldresults
ForceAnnealing_tocheck
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
FragmentAction_writes_AtomFragments
FragmentMolecule_checks_bonddegrees
GeometryObjects
Gui_Fixes
Gui_displays_atomic_force_velocity
ImplicitCharges
IndependentFragmentGrids
IndependentFragmentGrids_IndividualZeroInstances
IndependentFragmentGrids_IntegrationTest
IndependentFragmentGrids_Sole_NN_Calculation
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
JobMarket_unresolvable_hostname_fix
MoreRobust_FragmentAutomation
ODR_violation_mpqc_open
PartialCharges_OrthogonalSummation
PdbParser_setsAtomName
PythonUI_with_named_parameters
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
Rewrite_FitPartialCharges
RotateToPrincipalAxisSystem_UndoRedo
SaturateAtoms_findBestMatching
SaturateAtoms_singleDegree
StoppableMakroAction
Subpackage_CodePatterns
Subpackage_JobMarket
Subpackage_LinearAlgebra
Subpackage_levmar
Subpackage_mpqc_open
Subpackage_vmg
Switchable_LogView
ThirdParty_MPQC_rebuilt_buildsystem
TrajectoryDependenant_MaxOrder
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
TremoloParser_setsAtomName
Ubuntu_1604_changes
stable
Name
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Size
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Rev |
Age
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Author
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Last Change |
../
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VectorsQtQuery.cpp
|
2.2 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
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VectorQtQuery.cpp
|
3.3 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
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UnsignedIntsQtQuery.cpp
|
2.3 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
UnsignedIntQtQuery.cpp
|
2.1 KB
|
054025
|
12 years
|
ankele |
Fix: (UnsignedIntQtQuery) overwrite QSpinBox default maximum of 99
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StringsQtQuery.cpp
|
2.2 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
StringQtQuery.cpp
|
2.8 KB
|
dbf6c7
|
12 years
|
FrederikHeber |
StringQtQuery: ComboBox for discrete values
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RealSpaceMatrixQtQuery.cpp
|
2.5 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
RandomNumberDistribution_ParametersQtQuery.cpp
|
2.5 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
QtQueryList.hpp
|
5.2 KB
|
e59e8e
|
12 years
|
FrederikHeber |
ParserTypeValidator + And_Validator: values readable by QtQueryList
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QtQueryList.cpp
|
2.6 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
QtQuery.hpp
|
10.2 KB
|
dbf6c7
|
12 years
|
FrederikHeber |
StringQtQuery: ComboBox for discrete values
|
MoleculesQtQuery.cpp
|
2.3 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
MoleculeQtQuery.cpp
|
2.4 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
IntsQtQuery.cpp
|
2.2 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
IntQtQuery.cpp
|
1.8 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
FilesQtQuery.cpp
|
2.2 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
FileQtQuery.cpp
|
3.6 KB
|
5aaa43
|
12 years
|
FrederikHeber |
FIX: Fixed new copyright line since start of 2013 in CodeChecks test.
…
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EmptyQtQuery.cpp
|
1.6 KB
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94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
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ElementsQtQuery.cpp
|
2.3 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
ElementQtQuery.cpp
|
2.4 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
DoublesQtQuery.cpp
|
2.2 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
DoubleQtQuery.cpp
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2.0 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
BooleanQtQuery.cpp
|
2.0 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
AtomsQtQuery.cpp
|
2.2 KB
|
713a43
|
12 years
|
FrederikHeber |
QtQueryList can use STLVectorValidator's ElementwiseValidator
|
AtomQtQuery.cpp
|
2.3 KB
|
94d5ac6
|
12 years
|
FrederikHeber |
FIX: As we use GSL internally, we are as of now required to use GPL v2 …
|
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