source:
src/Fragmentation/Exporters@
aa91de0
Name | Size | Rev | Age | Author | Last Change |
---|---|---|---|---|---|
../ | |||||
unittests | 4ecb2d | 8 years | Moved LinearAlgebra sub-package into ThirdParty folder. - needed to … | ||
ExportGraph.cpp | 9.7 KB | 2affd1 | 9 years | Removed molecules_deprecated from World and unnecessary includes of … | |
ExportGraph.hpp | 3.4 KB | c24071 | 9 years | ExportGraph::operator() now returns bool. - FragmentationAction heeds … | |
ExportGraph_ToAtomFragments.cpp | 3.4 KB | c24071 | 9 years | ExportGraph::operator() now returns bool. - FragmentationAction heeds … | |
ExportGraph_ToAtomFragments.hpp | 1.4 KB | c24071 | 9 years | ExportGraph::operator() now returns bool. - FragmentationAction heeds … | |
ExportGraph_ToFiles.cpp | 8.3 KB | c24071 | 9 years | ExportGraph::operator() now returns bool. - FragmentationAction heeds … | |
ExportGraph_ToFiles.hpp | 2.3 KB | c24071 | 9 years | ExportGraph::operator() now returns bool. - FragmentationAction heeds … | |
ExportGraph_ToJobs.cpp | 13.1 KB | 9445081 | 8 years | FragmentJobQueue additionally stores the bond graph as an edge set per … | |
ExportGraph_ToJobs.hpp | 4.8 KB | 160ad7 | 9 years | ExportGraph_ToJobs::operator() now calculates a specific level for … | |
HydrogenPool.cpp | 4.4 KB | 910a5d | 10 years | atom::father is now accessible through getter and setter only. - this … | |
HydrogenPool.hpp | 2.4 KB | 11f0fa | 12 years | FIX: Newly created atoms must have trajectories reaching out till … | |
SaturatedBond.cpp | 4.4 KB | 2312fc6 | 9 years | SaturateBond now uses default angle and Bond length with warning when … | |
SaturatedBond.hpp | 2.2 KB | bac32f | 11 years | Added SaturatedBond as container for a "dangling bond" and its … | |
SaturatedFragment.cpp | 30.5 KB | c738f1 | 8 years | FIX: SaturatedFragment::getEdges(). - SaturatedFragment now keeps … | |
SaturatedFragment.hpp | 8.9 KB | c738f1 | 8 years | FIX: SaturatedFragment::getEdges(). - SaturatedFragment now keeps … | |
SaturationDistanceMaximizer.cpp | 10.1 KB | 185e6f | 11 years | MEMFIX: SaturationDistanceMaximizer::operator() did not delete Advocate. | |
SaturationDistanceMaximizer.hpp | 3.7 KB | 2a6d8c | 11 years | DOCUFIX: Doyxygen formula was broken in SaturationDistanceMaximizer. | |
SphericalPointDistribution.cpp | 39.7 KB | 3dadd5 | 9 years | Revert "Removing SphericalPointDistribution::getSimplePolygon() to … | |
SphericalPointDistribution.hpp | 8.9 KB | 3dadd5 | 9 years | Revert "Removing SphericalPointDistribution::getSimplePolygon() to … | |
SphericalPointDistribution_getConnections.cpp | 13.4 KB | 6393ff | 9 years | Added getConnections() to SphericalPointDistribution. - we use … | |
SphericalPointDistribution_getPoints.cpp | 12.8 KB | 0c42f2 | 9 years | Extended SaturateAction to be able to deal with bonded atoms. - … |
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