Rafael Ravedutti d61576699d Add first compilable version of Gromacs with SP ... Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>		2022-03-15 02:40:56 +01:00
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includes	Add first compilable version of Gromacs with SP	2022-03-15 02:40:56 +01:00
allocate.c	Add first version with more than one optimization scheme	2022-01-17 14:15:02 +01:00
atom.c	Add first working version with 4x8 config (ref kernel)	2022-03-10 22:33:41 +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 first compilable version of Gromacs with SP	2022-03-15 02:40:56 +01:00
main-stub.c	Add first draft version of GROMACS method separating i-clusters and j-clusters	2022-03-09 02:25:39 +01:00
main.c	Add first working version with 4x8 config (ref kernel)	2022-03-10 22:33:41 +01:00
neighbor.c	Add first working version with 4x8 config (ref kernel)	2022-03-10 22:33:41 +01:00
parameter.c	Allow parameter reading from files and update data	2022-03-05 03:21:52 +01:00
pbc.c	Add first working version with 4x8 config (ref kernel)	2022-03-10 22:33:41 +01:00
stats.c	Make code compilable	2022-03-09 17:23:49 +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	Make code compilable	2022-03-09 17:23:49 +01:00
xtc.c	Make code compilable	2022-03-09 17:23:49 +01:00