Andropov Arsenii
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055a009dbd
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Neighbor list preparation
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2023-05-23 16:25:00 +02:00 |
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Andropov Arsenii
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182c065fe2
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Neighbor list preparation
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2023-05-09 00:44:37 +02:00 |
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Andropov Arsenii
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ee3f6de050
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Building of super clusters complete, force computation kernel WIP
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2023-04-11 02:55:30 +02:00 |
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Rafael Ravedutti
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6eedf1776e
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Small fixes into GROMACS GPU code
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-11-14 18:21:14 +01:00 |
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Rafael Ravedutti
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93188d1383
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Adjust NVCC flags to avoid issues with atomicAdd with doubles
Signed-off-by: Rafael Ravedutti <rafaelravedutti@gmail.com>
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2022-11-14 18:01:46 +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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