#
# ChangeLog for src/Fragmentation/Graph.hpp
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# Generated by Trac 1.4.4
# Mar 19, 2025, 6:42:52 AM

Fri, 09 Aug 2013 14:20:38 GMT Frederik Heber <heber@…> [0331ee]
	* src/Fragmentation/Graph.hpp (modified)
	* src/Fragmentation/Interfragmenter.cpp (added)
	* src/Fragmentation/Interfragmenter.hpp (added)
	* src/Fragmentation/Makefile.am (modified)

	Added functor to add non-bonded union of fragments.

	- this is done ...


Fri, 14 Dec 2012 17:39:42 GMT Frederik Heber <heber@…> [bfbd4a]
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Fragmentation/Fragmentation.cpp (modified)
	* src/Fragmentation/Fragmentation.hpp (modified)
	* src/Fragmentation/Graph.cpp (modified)
	* src/Fragmentation/Graph.hpp (modified)

	Storing KeySet file with global ids now.

	- We now parse in key set ...


Fri, 14 Dec 2012 17:39:41 GMT Frederik Heber <heber@…> [e71325]
	* src/Fragmentation/AdaptivityMap.cpp (modified)
	* src/Fragmentation/AdaptivityMap.hpp (modified)
	* src/Fragmentation/Fragmentation.cpp (modified)
	* src/Fragmentation/Fragmentation.hpp (modified)
	* src/Fragmentation/Graph.cpp (modified)
	* src/Fragmentation/Graph.hpp (modified)

	FIX: All functions in Fragmentation and related now use const string ...


Mon, 03 Dec 2012 09:50:01 GMT Frederik Heber <heber@…> [b4f72c]
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.hpp (modified)
	* src/Fragmentation/Fragmentation.cpp (modified)
	* src/Fragmentation/Graph.cpp (modified)
	* src/Fragmentation/Graph.hpp (modified)
	* src/Fragmentation/SortIndex.cpp (modified)
	* src/Fragmentation/SortIndex.hpp (modified)
	* src/Fragmentation/fragmentation_helpers.cpp (modified)

	ExportGraph_ToFiles now does not require molecule reference anymore.
 ...


Mon, 03 Dec 2012 09:49:59 GMT Frederik Heber <heber@…> [ca8bea]
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph.hpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.hpp (modified)
	* src/Fragmentation/Fragmentation.cpp (modified)
	* src/Fragmentation/Fragmentation.hpp (modified)
	* src/Fragmentation/Graph.cpp (modified)
	* src/Fragmentation/Graph.hpp (modified)
	* src/Fragmentation/Makefile.am (modified)
	* src/molecule.cpp (modified)

	ExportGraph_ToFiles performs now the storing of the generated Graph ...


Tue, 25 Oct 2011 12:08:03 GMT Frederik Heber <heber@…> [730d7a]
	* src/Fragmentation/AdaptivityMap.cpp (added)
	* src/Fragmentation/AdaptivityMap.hpp (added)
	* src/Fragmentation/Fragmentation.cpp (modified)
	* src/Fragmentation/Graph.cpp (modified)
	* src/Fragmentation/Graph.hpp (modified)
	* src/Fragmentation/Makefile.am (modified)
	* src/Fragmentation/fragmentation_helpers.cpp (modified)
	* src/Fragmentation/fragmentation_helpers.hpp (modified)

	New class AdaptivityMap and moved some functions from ...


Tue, 25 Oct 2011 12:08:03 GMT Frederik Heber <heber@…> [75363b]
	* src/Fragmentation/Fragmentation.cpp (modified)
	* src/Fragmentation/Graph.cpp (modified)
	* src/Fragmentation/Graph.hpp (modified)
	* src/Fragmentation/KeySet.cpp (modified)
	* src/Fragmentation/KeySet.hpp (modified)
	* src/Fragmentation/fragmentation_helpers.cpp (modified)
	* src/Fragmentation/fragmentation_helpers.hpp (modified)

	Extracted functions from fragmentation_helpers and placed them in ...


Tue, 25 Oct 2011 12:08:03 GMT Frederik Heber <heber@…> [dadc74]
	* src/Fragmentation/BondsPerShortestPath.hpp (modified)
	* src/Fragmentation/Fragmentation.cpp (modified)
	* src/Fragmentation/Fragmentation.hpp (modified)
	* src/Fragmentation/Graph.cpp (added)
	* src/Fragmentation/Graph.hpp (added)
	* src/Fragmentation/Makefile.am (modified)
	* src/Fragmentation/PowerSetGenerator.hpp (modified)
	* src/Fragmentation/UniqueFragments.cpp (modified)
	* src/Fragmentation/UniqueFragments.hpp (modified)
	* src/Fragmentation/fragmentation_helpers.cpp (modified)
	* src/Fragmentation/fragmentation_helpers.hpp (modified)
	* src/graph.cpp (modified)
	* src/graph.hpp (modified)
	* src/molecule.hpp (modified)
	* src/moleculelist.cpp (modified)

	Extracted Graph (map of KeySets) into own class from graph.hpp.

	- ...