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MD-Bench
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MD-Bench
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.clang-format
.clang-tidy
.clangd
clusterpair/atom.c
clusterpair/cuda/force_lj.cu
clusterpair/force_eam.c
clusterpair/force_lj.c
clusterpair/includes/atom.h
clusterpair/includes/integrate.h
clusterpair/includes/neighbor.h
clusterpair/includes/pbc.h
clusterpair/includes/stats.h
clusterpair/includes/tracing.h
clusterpair/includes/vtk.h
clusterpair/includes/xtc.h
clusterpair/main-stub.c
clusterpair/main.c
clusterpair/neighbor.c
clusterpair/pbc.c
clusterpair/stats.c
clusterpair/tracing.c
clusterpair/vtk.c
clusterpair/xtc.c
common/allocate.c
common/device.c
common/eam_utils.c
common/includes/allocate.h
common/includes/device.h
common/includes/eam.h
common/includes/likwid-marker.h
common/includes/parameter.h
common/includes/simd.h
common/includes/simd/avx2_double.h
common/includes/simd/avx2_float.h
common/includes/simd/avx512_double.h
common/includes/simd/avx512_float.h
common/includes/simd/avx_double.h
common/includes/simd/avx_float.h
common/includes/thermo.h
common/includes/timers.h
common/includes/timing.h
common/includes/util.h
common/parameter.c
common/thermo.c
common/timing.c
common/util.c
config.mk
data/argon_1000/argon_1ns.gro
data/argon_1000/conf.gro
data/argon_1000/grompp.mdp
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