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Reducing "Wait GPU state copy" for single GPU runs
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11
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1639
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November 19, 2023
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Are these timings fine?
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3
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52
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November 14, 2023
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Keywords in command line for getting good performance in gromacs
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2
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96
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October 27, 2023
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1 millisecond Coarse Grained simulation
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2
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111
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September 24, 2023
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A series of performance benchmarks for MD Apps, including GROMACS
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16
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708
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September 4, 2023
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MD performance help using V_100 GPU
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7
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363
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June 21, 2023
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NVT memory error for free energy calculation
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1
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145
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April 4, 2023
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Users of spack-based GROMACS installations beware of possible performance loss!
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0
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198
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March 30, 2023
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Unevern spikes in RMSD graphs after MD simulations
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4
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308
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March 27, 2023
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New blog on multi-GPU scalability
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0
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243
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February 10, 2023
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GROMACS on Zen4: AVX2 vs AVX512
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0
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139
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February 3, 2023
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New blog post on maximizing GROMACS throughput on GPUs
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2
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564
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January 13, 2023
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Why load balancing is limited by minimum cell size in dimension X,Y,Z?
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1
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517
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September 5, 2022
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Regarding Editing the RAM and Compiling from GROMACS Source to improve performance
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0
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232
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April 27, 2022
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GROMACS performance on 8 cores workstation
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4
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801
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January 28, 2022
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Large % of "rest" time when running on GPU
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0
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466
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December 23, 2021
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Performance on Fujitsu A64FX
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3
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415
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July 19, 2021
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Efficient parallelization schme
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5
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422
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June 7, 2021
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Percentage of CPU and GPU runs
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1
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314
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May 11, 2021
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Domain decomposition error + Setting MPI ranks compatible with custom domains
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0
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478
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April 28, 2021
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Increase Performance of the simulation
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3
|
1825
|
April 27, 2021
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Quadro rtx 6000 performance
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2
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434
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April 19, 2021
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Speed Comparision against Maestro
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11
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1566
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April 12, 2021
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Performance degradation on 2021.1 with RTX 3070
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1
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559
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April 9, 2021
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PME tuning/rcoulomb scaling
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2
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1052
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March 29, 2021
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