Thank you prof Adrian for very quick reply.
What is the sped you would get if you ran just ONE simple md, not remd?
>
In simple md I am getting 4.43 ns/day on 16 CPU
> Are you using sander or pmemd?
>
> I am using sander
regards
Rahman
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Received on Wed Jun 07 2017 - 15:00:02 PDT