source:
src/Fragmentation/Exporters@
97d6ab
| Name | Size | Rev | Age | Author | Last Change |
|---|---|---|---|---|---|
| ../ | |||||
| unittests | 5aaa43 | 12 years | FIX: Fixed new copyright line since start of 2013 in CodeChecks test. … | ||
| SphericalPointDistribution.hpp | 12.7 KB | 97d6ab | 11 years | Added SphericalPointDistribution for points on spherical surface … | |
| SaturatedFragment.hpp | 6.3 KB | c39675 | 12 years | Added saturate() to SaturatedFragment. - basically, this is … | |
| SaturatedFragment.cpp | 19.1 KB | 9d3264 | 11 years | Refactored SaturatedFragment::saturate() using list of cut bonds. - … | |
| HydrogenPool.hpp | 2.4 KB | 11f0fa | 12 years | FIX: Newly created atoms must have trajectories reaching out till … | |
| HydrogenPool.cpp | 4.4 KB | 11f0fa | 12 years | FIX: Newly created atoms must have trajectories reaching out till … | |
| ExportGraph_ToJobs.hpp | 1.3 KB | ac9ca4 | 12 years | FragmentAction creates FragmentJobs if no output-types are given. - … | |
| ExportGraph_ToJobs.cpp | 4.5 KB | 1dfe00 | 11 years | Added inclusion switch on HAVE_JOBMARKET for files depending on … | |
| ExportGraph_ToFiles.hpp | 2.2 KB | 7cdf58 | 12 years | ExportGraph_ToFiles now uses one-by-one procedure to store fragments. … | |
| ExportGraph_ToFiles.cpp | 8.2 KB | 5aaa43 | 12 years | FIX: Fixed new copyright line since start of 2013 in CodeChecks test. … | |
| ExportGraph.hpp | 3.1 KB | 06804b | 11 years | Removed molecule::AddHydrogenReplacement() and BreadthFirstSearchAdd. … | |
| ExportGraph.cpp | 9.7 KB | 06804b | 11 years | Removed molecule::AddHydrogenReplacement() and BreadthFirstSearchAdd. … | |
|
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