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