BioD PNPI Git Repos - alexxy/gromacs.git/commit

author	Joe Jordan <ejjordan12@gmail.com>
	Mon, 28 Sep 2020 10:35:59 +0000 (10:35 +0000)
committer	Joe Jordan <ejjordan12@gmail.com>
	Mon, 28 Sep 2020 10:35:59 +0000 (10:35 +0000)
commit	d1db0d0fb0141abb024ecabaf27a6b8daf6ea790
tree	ce1863c29d92e004892f6cf3cbda3a97ae47db4a	tree \| snapshot
parent	f810e1d85e274678388083277a0af48d03eb7556	commit \| diff

Add initial nblib public API

27 files changed:

api/CMakeLists.txt		diff \| blob \| history
api/nblib/CMakeLists.txt	[new file with mode: 0644]	blob
api/nblib/basicdefinitions.h	[new file with mode: 0644]	blob
api/nblib/box.cpp	[new file with mode: 0644]	blob
api/nblib/box.h	[new file with mode: 0644]	blob
api/nblib/exception.h	[new file with mode: 0644]	blob
api/nblib/forcecalculator.h	[new file with mode: 0644]	blob
api/nblib/integrator.h	[new file with mode: 0644]	blob
api/nblib/interactions.h	[new file with mode: 0644]	blob
api/nblib/kerneloptions.h	[new file with mode: 0644]	blob
api/nblib/molecules.h	[new file with mode: 0644]	blob
api/nblib/nblib.h	[new file with mode: 0644]	blob
api/nblib/particletype.h	[new file with mode: 0644]	blob
api/nblib/simulationstate.h	[new file with mode: 0644]	blob
api/nblib/tests/CMakeLists.txt	[new file with mode: 0644]	blob
api/nblib/tests/box.cpp	[new file with mode: 0644]	blob
api/nblib/tests/testhelpers.cpp	[new file with mode: 0644]	blob
api/nblib/tests/testhelpers.h	[new file with mode: 0644]	blob
api/nblib/topology.h	[new file with mode: 0644]	blob
api/nblib/topologyhelpers.h	[new file with mode: 0644]	blob
api/nblib/util/CMakeLists.txt	[new file with mode: 0644]	blob
api/nblib/util/user.h	[new file with mode: 0644]	blob
api/nblib/vector.h	[new file with mode: 0644]	blob
docs/CMakeLists.txt		diff \| blob \| history
docs/index.rst		diff \| blob \| history
docs/nblib/guide-to-writing-MD-programs.rst	[new file with mode: 0644]	blob
docs/nblib/index.rst	[new file with mode: 0644]	blob

Local GROMACS mirror with custom stuff