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MD-Bench/gromacs/includes
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Rafael Ravedutti af92800c64 Add SIMD version with AVX (no AVX2) and XTC output 
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-03-02 23:12:04 +01:00
..
allocate.h
Add first version with more than one optimization scheme
2022-01-17 14:15:02 +01:00
atom.h
Write function to read PDB files and include data for Argon simulation
2022-02-24 02:36:17 +01:00
eam.h
Add first version with more than one optimization scheme
2022-01-17 14:15:02 +01:00
likwid-marker.h
Add first version with more than one optimization scheme
2022-01-17 14:15:02 +01:00
neighbor.h
Add prunning kernel
2022-02-28 17:20:39 +01:00
parameter.h
Add SIMD version with AVX (no AVX2) and XTC output
2022-03-02 23:12:04 +01:00
pbc.h
Perform a few fixes for gromacs variant
2022-01-31 17:49:22 +01:00
simd.h
Add SIMD version with AVX (no AVX2) and XTC output
2022-03-02 23:12:04 +01:00
stats.h
Add clusters efficiency on stats
2022-02-28 16:10:09 +01:00
thermo.h
Add first version with more than one optimization scheme
2022-01-17 14:15:02 +01:00
timers.h
Add first version with more than one optimization scheme
2022-01-17 14:15:02 +01:00
timing.h
Add first version with more than one optimization scheme
2022-01-17 14:15:02 +01:00
tracing.h
Add first version with more than one optimization scheme
2022-01-17 14:15:02 +01:00
util.h
Fix exclusion masks and add SIMD debug tools
2022-02-02 21:54:18 +01:00
vtk.h
Separate local and ghost cluster edges on VTK output
2022-02-08 16:12:22 +01:00
xtc.h
Add SIMD version with AVX (no AVX2) and XTC output
2022-03-02 23:12:04 +01:00