[gmx-users] gromacs with mps

Mahmood Naderan nt_mahmood at yahoo.com
Fri Jul 27 21:20:25 CEST 2018

Has anyone run gmx_mpi with MPS? Even with small input files (which are working fine when MPS is turned off), I get out of memory error from the GPU device.
Don't know if there is a bug inside cuda or gromacs. I see some other related topics for other programs. So, it sound like a cuda problem.
If you have worked with MPS, please let me know.


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