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(parent: 52a77ce) | patch
Add nblib backend: Part 2 of 2
authorJoe Jordan <ejjordan12@gmail.com>
Tue, 29 Sep 2020 13:48:33 +0000 (13:48 +0000)
committerArtem Zhmurov <zhmurov@gmail.com>
Tue, 29 Sep 2020 13:48:33 +0000 (13:48 +0000)
commitc0d698dfb0dc87af2f03e19860c832ad262d6b8d
treebf87a6befa8aebd98afedb4586be40dae73d71dctree | snapshot
parent52a77ce5569d870d484c6db2f49a349eb1bf96a8commit | diff
Add nblib backend: Part 2 of 2
19 files changed:
api/nblib/CMakeLists.txt diff | blob | history
api/nblib/forcecalculator.cpp [new file with mode: 0644] blob
api/nblib/gmxcalculator.cpp [new file with mode: 0644] blob
api/nblib/gmxcalculator.h [new file with mode: 0644] blob
api/nblib/gmxsetup.cpp [new file with mode: 0644] blob
api/nblib/gmxsetup.h [new file with mode: 0644] blob
api/nblib/integrator.cpp [new file with mode: 0644] blob
api/nblib/simulationstate.cpp [new file with mode: 0644] blob
api/nblib/simulationstateimpl.h [new file with mode: 0644] blob
api/nblib/tests/CMakeLists.txt diff | blob | history
api/nblib/tests/gmxcalculator.cpp [new file with mode: 0644] blob
api/nblib/tests/integrator.cpp [new file with mode: 0644] blob
api/nblib/tests/nbkernelsystem.cpp [new file with mode: 0644] blob
api/nblib/tests/nbnxnsetup.cpp [new file with mode: 0644] blob
api/nblib/tests/refdata/NBlibTest_ArgonForcesAreCorrect.xml [new file with mode: 0644] blob
api/nblib/tests/refdata/NBlibTest_SpcMethanolForcesAreCorrect.xml [new file with mode: 0644] blob
api/nblib/tests/simstate.cpp [new file with mode: 0644] blob
api/nblib/tests/testsystems.cpp diff | blob | history
api/nblib/tests/testsystems.h diff | blob | history
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