[gmx-users] problems for GPU simulations

Albert mailmd2011 at gmail.com
Thu Feb 7 11:31:46 CET 2013


On 02/07/2013 11:28 AM, James Starlight wrote:
> Also could you tell me what your system has performance (in gflops)
> and what system you have simulated on it (average atom number,
> presence of explicit membrane etc)?

it is something around 55,000 atoms with explicit membrane. I am using 
Slipids FF which is compatible with Amber FF. This is good for ligand 
topology.



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