Commit Graph

16 Commits

Author SHA1 Message Date
Rafael Ravedutti
296a4c4e01 Set interaction masks as gromacs does
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2023-03-23 00:58:25 +01:00
Rafael Ravedutti
e5c233e072 Update script
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-12-21 18:04:18 +01:00
Rafael Ravedutti
292138b270 Write debug_printf to avoid warnings and fix latency/cfd script
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-12-14 16:17:28 +01:00
Rafael Ravedutti
cd37746d07 Add script to automate latency and CFD evaluation
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-12-13 15:35:41 +01:00
Rafael Ravedutti
a7cb888517 Fix compilation for ICX compiler
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-12-13 00:59:31 +01:00
Rafael Ravedutti
416f042fc0 Fix readline() when fgets returns NULL even on success
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-11-30 17:43:35 +01:00
Rafael Ravedutti
bc06220aeb Remove AVX512 reciprocal usage in AVX2 file
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-11-15 01:40:37 +01:00
Rafael Ravedutti
efa462d0af Add AVX_FMA ISA
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-11-15 01:24:30 +01:00
Rafael Ravedutti
cd1fbfb3c8 Reorganize SIMD files and split AVX and AVX2
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-11-15 00:55:46 +01:00
Rafael Ravedutti
c70ebce4c1 Integrate GROMACS GPU implementation into master branch
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-11-08 18:33:23 +01:00
Rafael Ravedutti
493915fe95 Fix code for AVX and remove warnings
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-11-08 15:30:37 +01:00
Rafael Ravedutti
437b380229 Adjust NVCC flags
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-11-07 20:37:01 +01:00
Rafael Ravedutti
35a8e3eeb7 Fix header of likwid-marker.h
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-09-29 11:48:05 +02:00
Jan Eitzinger
3d0f4b97ee Switch copyright header in source files. 2022-09-05 10:39:42 +02:00
Rafael Ravedutti
28d3946072 Move common modules to common directory
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-08-17 17:56:31 +02:00
Rafael Ravedutti
47db9e86b0 Introduce common directory
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
2022-08-17 17:20:57 +02:00