source: src/Fragmentation/Automation@ 5b3781

FitPartialCharges_GlobalError PartialCharges_OrthogonalSummation
Name Size Rev Age Author Last Change
../
VMGFragmentController.hpp 3.2 KB ​ 666e9e   9 years FrederikHeber VMGFragmentController and FragmentationAutomationAction accept …
VMGFragmentController.cpp 7.6 KB ​ eaef9b   9 years FrederikHeber Modying nfc by power of 2 for each additional level in fragment grid.
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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