A series of performance benchmarks for MD Apps, including GROMACS

This has been mentioned in the main text:

However, when it comes to the gfx1100 (RDNA 3) GPU, operation stability is a concern across all three versions of ROCm. Specifically, performance fluctuations and a high probability of mdrun getting stuck after running for a period of time have been observed (similar feedback was reported on the GROMACS forum in June of this year). Furthermore, GPU status information cannot be recognized by rocm-smi in this case.

I think the unstability is due to the fact that AMD ROCm does not yet officially support RDNA3. Two months ago someone posted a similar issue on this forum: GROMACS get stuck AMD GPU