[gmx-users] Optimal GPU setup for workstation with Gromacs 5

[Jingjie]

Dear all, 

 

My workstation specs are 2 x Intel Xeon E5-2695v2 2.40 GHz, 12 Cores. I
would like to combine this with an optimal GPU setup for Gromacs 5 running
simulations with millions of atoms. May I know what are the recommended
setups? My vendor proposed doing a dual K40 Tesla GPU setup, would that be
optimal?

 

Best Regards,

JJ