Rafael Ravedutti
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2e77f6207b
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Avoid errors when compiling for AVX2 due to SIMD LJ implementation
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-07-19 02:30:26 +02:00 |
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Rafael Ravedutti
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ab2eb1ff50
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Write LAMMPS kernel with SIMD intrinsics and implement AVX512 with double-precision functions
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-04-05 02:57:23 +02:00 |
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Rafael Ravedutti
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fdbeed4368
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Fix AVX2 versions with half neighbor lists
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-27 16:39:39 +02:00 |
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Rafael Ravedutti
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0e742766b7
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Add working version of Simd4xn kernel with half neighbor lists
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-23 15:54:18 +01:00 |
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Rafael Ravedutti
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e72323ab6a
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Fix Simd2xnn Kernel with half neighbor lists and add AVX512 intrinsics with double
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-23 15:21:07 +01:00 |
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Rafael Ravedutti
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94521f03b3
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Fix reference version with half neighbor lists
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-23 14:31:47 +01:00 |
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Rafael Ravedutti
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8709bc2a06
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Add first version for half neighbor lists in GROMACS variant
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-22 23:47:05 +01:00 |
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Rafael Ravedutti
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887f41871c
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Add parameter reading for LAMMPS variant
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-17 02:44:34 +01:00 |
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Rafael Ravedutti
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d4b34e1fa4
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Fix intrinsics for AVX2
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-17 00:35:21 +01:00 |
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Rafael Ravedutti
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4090f43095
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Optimize partial forces reduction for compute_4xn kernel
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-16 17:54:52 +01:00 |
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Rafael Ravedutti
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f3263a2d48
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Separate simd file into multiple files
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-03-16 14:52:55 +01:00 |
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