HIP version of GROMACS
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8
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135
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June 27, 2022
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Correct MDP parameters for -update GPU
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1
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33
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June 21, 2022
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Does GROMACS supports GPU acceleration on M1 Mac?
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6
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309
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June 18, 2022
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Mdrun error with GPU in MacOS
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3
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99
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May 18, 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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45
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April 27, 2022
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Gormacs installation-enabling GPU
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9
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875
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April 3, 2022
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Analysis of interaction between GOLD and protein
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1
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59
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March 31, 2022
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GROMACS 2022+CP2K with GPU
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2
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95
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March 29, 2022
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How to recompile GROMACS with GPU support?
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2
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91
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March 19, 2022
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Gpu compatibility with GROMACS
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3
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175
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March 8, 2022
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GROMACS mdrun on GPU has become very slow recently
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0
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94
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February 9, 2022
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GPU usage with PBS
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0
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47
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December 14, 2021
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GPU Utilization in Gromacs2021.3 is low, about 80%
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5
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105
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December 14, 2021
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Running Gromacs in GPU vs CPU
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1
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155
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December 3, 2021
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GPU questions
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6
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288
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November 14, 2021
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Simulations with free energy calculations on GPU is several time slower than normal simulations
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2
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108
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November 4, 2021
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New blog post on maximizing GROMACS throughput on GPUs
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0
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143
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October 11, 2021
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Building a system for enhanced sampling MD with Gromacs - help choosing GPUs
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2
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105
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September 13, 2021
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Segmentation fault on NVT, free energy calculation
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4
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210
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August 19, 2021
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How to Specify GPU core ID in mdrun
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2
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274
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August 18, 2021
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Error when using more than one GPU core on the same node
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0
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105
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August 12, 2021
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AMD or NVIDIA gpu, which is faster at same price level?
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1
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129
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July 29, 2021
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Maximum performance GPU Gromacs 2021
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0
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259
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July 26, 2021
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Percentage of CPU and GPU runs
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1
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116
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May 11, 2021
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Cmake problem
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6
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125
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May 6, 2021
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Parallelization over several GPU nodes
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2
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196
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March 30, 2021
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Accelerating PME on the CPU
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8
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371
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March 30, 2021
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How do I enter numbers for prompts in my scripts
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3
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444
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March 23, 2021
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