#
# ChangeLog for src/Fragmentation/Exporters/ExportGraph.hpp
#
# Generated by Trac 1.6
# May 25, 2025, 11:01:08 PM

Wed, 14 Sep 2016 18:42:52 GMT Frederik Heber <heber@…> [c24071]
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph.hpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToAtomFragments.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToAtomFragments.hpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.hpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.hpp (modified)

	ExportGraph::operator() now returns bool.

	- FragmentationAction ...


Thu, 11 Feb 2016 08:07:11 GMT Frederik Heber <heber@…> [df5b8c]
	* 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)

	Replaced MoleculeListClass in ExportGraph by vector of molecules.

	- ...


Sat, 16 Aug 2014 15:52:30 GMT Frederik Heber <heber@…> [98a293b]
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Actions/FragmentationAction/StoreSaturatedFragmentAction.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/Exporters/ExportGraph_ToJobs.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.hpp (modified)
	* src/Fragmentation/Exporters/SaturatedFragment.cpp (modified)
	* src/Fragmentation/Exporters/SaturatedFragment.hpp (modified)
	* src/Fragmentation/Exporters/unittests/SaturatedFragmentUnitTest.cpp (modified)
	* src/Fragmentation/Summation/Converter/DataConverter.hpp (modified)

	SaturatedFragment can deal with a global saturation position map.

	- ...


Thu, 14 Aug 2014 14:49:51 GMT Frederik Heber <heber@…> [06804b]
	* src/Fragmentation/Exporters/ExportGraph.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph.hpp (modified)
	* src/Graph/BreadthFirstSearchAdd.cpp (deleted)
	* src/Graph/BreadthFirstSearchAdd.hpp (deleted)
	* src/Graph/Makefile.am (modified)
	* src/molecule.cpp (modified)
	* src/molecule.hpp (modified)

	Removed molecule::AddHydrogenReplacement() and BreadthFirstSearchAdd. ...


Mon, 15 Apr 2013 10:28:22 GMT Frederik Heber <heber@…> [ac9ca4]
	* configure.ac (modified)
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Actions/FragmentationAction/FragmentationAction.def (modified)
	* src/Actions/FragmentationAction/FragmentationAutomationAction.cpp (modified)
	* src/Actions/FragmentationAction/FragmentationAutomationAction.def (modified)
	* src/Actions/FragmentationAction/StoreSaturatedFragmentAction.def (modified)
	* src/Fragmentation/Automation/FragmentJobQueue.cpp (added)
	* src/Fragmentation/Automation/FragmentJobQueue.hpp (added)
	* src/Fragmentation/Automation/MPQCFragmentController.cpp (modified)
	* src/Fragmentation/Automation/MPQCFragmentController.hpp (modified)
	* src/Fragmentation/Automation/Makefile.am (modified)
	* src/Fragmentation/Exporters/ExportGraph.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph.hpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.hpp (modified)
	* src/Fragmentation/KeySetsContainer.cpp (modified)
	* src/Fragmentation/KeySetsContainer.hpp (modified)
	* src/Fragmentation/Makefile.am (modified)

	FragmentAction creates FragmentJobs if no output-types are given.

	- ...


Mon, 08 Apr 2013 11:56:08 GMT Frederik Heber <heber@…> [6cabaac]
	* src/Fragmentation/Exporters/ExportGraph.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph.hpp (modified)

	Extended ExportGraph to spill our molecular fragments one by one.

	- ...


Mon, 08 Apr 2013 11:56:08 GMT Frederik Heber <heber@…> [8652a30]
	* 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/Exporters/ExportGraph_ToJobs.cpp (modified)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.hpp (modified)
	* src/Fragmentation/Makefile.am (modified)

	Moved some functions from ExportGraph_ToFiles into ExportGraph.

	- ...


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 ...


Mon, 03 Dec 2012 09:49:30 GMT Frederik Heber <heber@…> [de0af2]
	* src/Fragmentation/Exporters/ExportGraph.cpp (added)
	* src/Fragmentation/Exporters/ExportGraph.hpp (added)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.cpp (added)
	* src/Fragmentation/Exporters/ExportGraph_ToFiles.hpp (added)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.cpp (added)
	* src/Fragmentation/Exporters/ExportGraph_ToJobs.hpp (added)
	* tests/CodeChecks/testsuite-header-dist.at (modified)

	Added some initial files for exporting a fragmented system to ...