source: src/Fragmentation/Summation

stable v1.7.0
Name Size Rev Age Author Last Change
../
Containers 9eb71b3   9 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
Converter 6829d2   9 years FrederikHeber MPQCData additionally stores the atomic number per nuclei. - in case …
SetValues 0c8989   4 years frederik.heber Enhanced assert message for IndexedVectors.
unittests 748fc7   11 years FrederikHeber libMolecuilder is now a shared library. - linking error …
AllLevelOrthogonalSummator.hpp 4.9 KB ​ da098d2   9 years FrederikHeber ..Summators and AllLevel..Summators pass through ZeroInstance, added …
AllLevelSummator.hpp 4.8 KB ​ da098d2   9 years FrederikHeber ..Summators and AllLevel..Summators pass through ZeroInstance, added …
HeaderPrinter.hpp 1.1 KB ​ 47cee7   12 years FrederikHeber Writing out energy file with value and contribution per index set - …
IndexSet.cpp 3.7 KB ​ 9eb71b3   9 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
IndexSet.hpp 2.0 KB ​ dde50d   9 years frederik.heber FIX: boost::serialization 1.58 introduced changes which breaks …
IndexSetContainer.cpp 4.7 KB ​ 9eb71b3   9 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
IndexSetContainer.hpp 3.9 KB ​ 781408   13 years FrederikHeber FIX: Added inline comparators for IndexSet::ptr, fixed …
Makefile.am 4.0 KB ​ 0ee9cb3   9 years FrederikHeber FIX: Removed multiple instances of libmolecuilder_config.h in …
OrthogonalSummation.hpp 2.4 KB ​ ff7ac6   9 years FrederikHeber BREAKS: Summation and OrthogonalSummation both now allow to set a …
OrthogonalSummation_impl.hpp 2.6 KB ​ 3d444a   9 years FrederikHeber (Orthogonal)Summation's Sum() can be further simplified now.
OrthogonalSummator.hpp 7.3 KB ​ da098d2   9 years FrederikHeber ..Summators and AllLevel..Summators pass through ZeroInstance, added …
OrthogonalSumUpPerLevel.hpp 3.3 KB ​ 409a05   9 years FrederikHeber ..SumUpPerLevel are now functors that allow to set the zero instance …
printKeyNames.hpp 732 bytes ​ 1f66c7   13 years FrederikHeber Renamed and extracted namespace FusionKeyNames -> printKeyNames. - …
SetValue.hpp 4.4 KB ​ 58952a   12 years FrederikHeber SetValue treats ZeroInstance as value special. - ZeroInstance in …
SetValueMap.hpp 3.5 KB ​ 07266b   13 years FrederikHeber Added SetValueMap::getConstValue() for getting const reference to SetValue.
SortedVector.hpp 4.3 KB ​ 19c50e   13 years FrederikHeber IndexSetContainer now treats super set specially. - The super set …
SubsetMap.cpp 7.6 KB ​ 9eb71b3   9 years frederik.heber Commented out MemDebug include and Memory::ignore. - MemDebug clashes …
SubsetMap.hpp 3.5 KB ​ 19c50e   13 years FrederikHeber IndexSetContainer now treats super set specially. - The super set …
Summation.hpp 2.3 KB ​ ff7ac6   9 years FrederikHeber BREAKS: Summation and OrthogonalSummation both now allow to set a …
Summation_impl.hpp 2.5 KB ​ 3d444a   9 years FrederikHeber (Orthogonal)Summation's Sum() can be further simplified now.
Summator.hpp 7.1 KB ​ da098d2   9 years FrederikHeber ..Summators and AllLevel..Summators pass through ZeroInstance, added …
SumUpPerLevel.hpp 2.9 KB ​ 409a05   9 years FrederikHeber ..SumUpPerLevel are now functors that allow to set the zero instance …
ValuePrinter.hpp 1.3 KB ​ 47cee7   12 years FrederikHeber Writing out energy file with value and contribution per index set - …
writeIndexedTable.hpp 2.8 KB ​ c8d13f5   12 years FrederikHeber Summed up results are now handed-over to FragmentationResultContainer …
writeTable.hpp 1.7 KB ​ 47cee7   12 years FrederikHeber Writing out energy file with value and contribution per index set - …
ZeroInstance.hpp 854 bytes ​ 58952a   12 years FrederikHeber SetValue treats ZeroInstance as value special. - ZeroInstance in …
ZeroInstanceInitializer.hpp 1.4 KB ​ da098d2   9 years FrederikHeber ..Summators and AllLevel..Summators pass through ZeroInstance, added …
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