Hi,
Unless you are studying large systems ( 10e6 atoms ) do as Carsten suggests.
Get a good Intel or AMD 8 core and the best GPU you can afford. Don’t worry
too much about the speed of the CPU either. 3.2 Ghz is fine.
p
> On Jun 9, 2019, at 6:43 AM, Kutzner, Carsten wrote:
>
> Hi,
>
>
Hi,
don’t spend all your money on a CPU - for high GROMACS performance
the GPU is as important. I would recommend to add an RTX 2070/80 GPU
to the workstation, and get a cheaper CPU. This will most likely
give you a significantly higher GROMACS performance.
See https://arxiv.org/abs/1903.05918
Dear all gromacs users,
I'm now about to configure workstation for gromacs.
I searched on the internet, and I could find some information from
servethehome.
But in here (
https://www.realworldtech.com/forum/?threadid=181985=182058)
Somebody said that Xeon W-2145 will be faster than anything in
