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

author	Joe Jordan <ejjordan12@gmail.com>
	Sun, 6 Jun 2021 20:50:28 +0000 (20:50 +0000)
committer	Artem Zhmurov <zhmurov@gmail.com>
	Sun, 6 Jun 2021 20:50:28 +0000 (20:50 +0000)
commit	100125464e111f9925b8aa9e4e12098fc4510f24
tree	1d3ac48c8533ce37901e2055117d5f40ca7f5a1f	tree \| snapshot
parent	3d14d8cae7d5838958cc29bd4e5cda6edd0314fa	commit \| diff

Updates to nblib test infra and tests

22 files changed:

api/nblib/box.cpp		diff \| blob \| history
api/nblib/box.h		diff \| blob \| history
api/nblib/listed_forces/tests/calculator.cpp		diff \| blob \| history
api/nblib/tests/CMakeLists.txt		diff \| blob \| history
api/nblib/tests/box.cpp		diff \| blob \| history
api/nblib/tests/gmxcalculator.cpp		diff \| blob \| history
api/nblib/tests/integrator.cpp		diff \| blob \| history
api/nblib/tests/interactions.cpp		diff \| blob \| history
api/nblib/tests/molecules.cpp		diff \| blob \| history
api/nblib/tests/nbkernelsystem.cpp		diff \| blob \| history
api/nblib/tests/refdata/NBlibTest_ArgonGromos43A1ForcesAreCorrect.xml	[new file with mode: 0644]	blob
api/nblib/tests/refdata/NBlibTest_ArgonOplsaForcesAreCorrect.xml	[new file with mode: 0644]	blob
api/nblib/tests/refdata/NBlibTest_SpcMethanolEnergiesAreCorrect.xml	[new file with mode: 0644]	blob
api/nblib/tests/refdata/NBlibTest_SpcMethanolForcesAreCorrectOnGpu.xml	[new file with mode: 0644]	blob
api/nblib/tests/refdata/TprReaderTest_ArgonImportedDataIsCorrect.xml	[new file with mode: 0644]	blob
api/nblib/tests/refdata/TprReaderTest_FCfromTprDataWorks.xml	[new file with mode: 0644]	blob
api/nblib/tests/simstate.cpp		diff \| blob \| history
api/nblib/tests/testhelpers.h		diff \| blob \| history
api/nblib/tests/testsystems.cpp		diff \| blob \| history
api/nblib/tests/testsystems.h		diff \| blob \| history
api/nblib/tests/topology.cpp		diff \| blob \| history
api/nblib/util/tests/setup.cpp		diff \| blob \| history

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