[gmx-users] about exchange replica with replicas 140

[#ZHANG HAIPING#]

Dear gromacs user:

I have encounter a problem when used HPC(high performance computer) to run replica exchange. I find that when I used replica over 128, it will not work, while under 128 , it is ok, even when I used cores much more than 128(several cores for one replica). The version  I used is gromacs-4.6.2-double-intel. Hope for you help.


Best regards,

Haiping Zhang