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# ChangeLog for src/Fragmentation/Interfragmenter.hpp
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# Generated by Trac 1.4.4
# Mar 20, 2025, 1:04:40 PM

Wed, 18 May 2016 22:02:07 GMT Frederik Heber <heber@…> [d410e25]
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Fragmentation/Interfragmenter.cpp (modified)
	* src/Fragmentation/Interfragmenter.hpp (modified)

	Interfragmenter now access singleton AtomFragmentsMap.

	- i.e. we do ...


Wed, 18 May 2016 22:02:06 GMT Frederik Heber <heber@…> [d713ce]
	* src/Fragmentation/Homology/AtomFragmentsMap.cpp (moved)
	* src/Fragmentation/Homology/AtomFragmentsMap.hpp (moved)
	* src/Fragmentation/Interfragmenter.cpp (modified)
	* src/Fragmentation/Interfragmenter.hpp (modified)
	* src/Fragmentation/Makefile.am (modified)

	AtomFragmentsMap is now a Singleton and part of Homology code.


Wed, 18 May 2016 22:02:06 GMT Frederik Heber <heber@…> [bd6e5c]
	* src/Fragmentation/AtomFragmentsMap.cpp (modified)
	* src/Fragmentation/AtomFragmentsMap.hpp (modified)
	* src/Fragmentation/Interfragmenter.cpp (modified)
	* src/Fragmentation/Interfragmenter.hpp (modified)

	Prepared AtomFragmentsMap to work in ids, not instances.

	- no more ...


Wed, 18 May 2016 22:02:06 GMT Frederik Heber <heber@…> [d45ed9]
	* src/Fragmentation/AtomFragmentsMap.cpp (added)
	* src/Fragmentation/AtomFragmentsMap.hpp (added)
	* src/Fragmentation/Interfragmenter.cpp (modified)
	* src/Fragmentation/Interfragmenter.hpp (modified)
	* src/Fragmentation/Makefile.am (modified)

	Abstracted atom -> fragment association out of Interfragmenter.


Tue, 13 Oct 2015 20:14:32 GMT Frederik Heber <heber@…> [cee9e8]
	* src/Actions/FragmentationAction/FragmentationAction.cpp (modified)
	* src/Fragmentation/Interfragmenter.cpp (modified)
	* src/Fragmentation/Interfragmenter.hpp (modified)

	Added Interfragmenter::findLargestCutoff() to find largest Rcut not ...


Tue, 13 Oct 2015 20:14:32 GMT Frederik Heber <heber@…> [b1c5f46]
	* src/Fragmentation/Interfragmenter.cpp (modified)
	* src/Fragmentation/Interfragmenter.hpp (modified)

	Interfragmenter now combines two fragments up to (in sum) till ...


Tue, 13 Oct 2015 20:14:32 GMT Frederik Heber <heber@…> [0d9053]
	* src/Fragmentation/Interfragmenter.cpp (modified)
	* src/Fragmentation/Interfragmenter.hpp (modified)

	Exracted several functions out of Interfragmenter::operator().

	- ...


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 ...