source: src/Fragmentation/Automation@ e6a2ef

FitPartialCharges_GlobalError
Name Size Rev Age Author Last Change
../
VMGFragmentController.hpp 3.7 KB a3d08c   8 years FrederikHeber Extracted VMGFragmentController::getFullPositions().
VMGFragmentController.cpp 7.9 KB a3d08c   8 years FrederikHeber Extracted VMGFragmentController::getFullPositions().
VMGDebugGridFragmentController.hpp 1.6 KB d4eaf1   11 years FrederikHeber Renamed ResultContainer -> ReceivedResultContainer. - this belongs to …
VMGDebugGridFragmentController.cpp 1.9 KB f6c19d   12 years FrederikHeber InterfaceVMGDebugJob now also uses optionally open boundary (FAS …
SpecificFragmentController_ReceiveResultContainer_impl.hpp 2.4 KB ca09be   10 years FrederikHeber FIX: FragmentationAutomationAction checks FragmentControllers' …
SpecificFragmentController.hpp 2.7 KB a498c1   11 years FrederikHeber Extracted ResultContainer from ReceiveResultContainer.
SpecificFragmentController.cpp 1.9 KB d9f2b3   11 years FrederikHeber SpecificFragmentController has a ref to an updatehandler to call in …
ResultContainer_impl.hpp 2.4 KB 7537d1   10 years FrederikHeber Removing setting net force to zero and setting hasForce to true.
ResultContainer.hpp 1.5 KB a498c1   11 years FrederikHeber Extracted ResultContainer from ReceiveResultContainer.
MPQCFragmentController.hpp 1.9 KB d4eaf1   11 years FrederikHeber Renamed ResultContainer -> ReceivedResultContainer. - this belongs to …
MPQCFragmentController.cpp 2.4 KB 07ecc5   11 years FrederikHeber FIX: FragmentationAutomationAction did not fail correctly with …
MPQCCommandFragmentController.hpp 2.8 KB b569b8   10 years FrederikHeber FIX: MPQCCommandFragmentController failed to add jobs due to false …
MPQCCommandFragmentController.cpp 3.6 KB b569b8   10 years FrederikHeber FIX: MPQCCommandFragmentController failed to add jobs due to false …
Makefile.am 4.0 KB 3b35e7   11 years FrederikHeber Fixes due to update to Ubuntu 14.04. - subdir-objects is default …
FragmentJobQueue.hpp 4.6 KB 9445081   9 years FrederikHeber FragmentJobQueue additionally stores the bond graph as an edge set per …
FragmentJobQueue.cpp 4.8 KB 9445081   9 years FrederikHeber FragmentJobQueue additionally stores the bond graph as an edge set per …
  • Property mode set to 040000
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