MD-Bench/gromacs
Rafael Ravedutti ba6785a865 Allow parameter reading from files and update data
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-03-05 03:21:52 +01:00
..
includes Allow parameter reading from files and update data 2022-03-05 03:21:52 +01:00
allocate.c Add first version with more than one optimization scheme 2022-01-17 14:15:02 +01:00
atom.c Allow parameter reading from files and update data 2022-03-05 03:21:52 +01:00
eam_utils.c Add first version with more than one optimization scheme 2022-01-17 14:15:02 +01:00
force_eam.c Add first version of force calculation with cluster scheme 2022-01-28 18:07:41 +01:00
force_lj.c Add clusters efficiency on stats 2022-02-28 16:10:09 +01:00
main-stub.c Add first version with more than one optimization scheme 2022-01-17 14:15:02 +01:00
main.c Allow parameter reading from files and update data 2022-03-05 03:21:52 +01:00
neighbor.c Add prunning kernel 2022-02-28 17:20:39 +01:00
parameter.c Allow parameter reading from files and update data 2022-03-05 03:21:52 +01:00
pbc.c Add first kernel using SIMD instrinsics for 4xn cases 2022-02-02 18:00:44 +01:00
stats.c Add clusters efficiency on stats 2022-02-28 16:10:09 +01:00
thermo.c Allow parameter reading from files and update data 2022-03-05 03:21:52 +01:00
timing.c Add first version with more than one optimization scheme 2022-01-17 14:15:02 +01:00
tracing.c Add first version of force calculation with cluster scheme 2022-01-28 18:07:41 +01:00
util.c Add first version with more than one optimization scheme 2022-01-17 14:15:02 +01:00
vtk.c Separate local and ghost cluster edges on VTK output 2022-02-08 16:12:22 +01:00
xtc.c Add SIMD version with AVX (no AVX2) and XTC output 2022-03-02 23:12:04 +01:00