On 10/23/14 6:02 AM, Yaser Hosseini wrote:
hi
Reading file md.tpr, VERSION 4.6.5 (single precision)
Using 4 MPI threads
Compiled acceleration: SSE4.1 (Gromacs could use AVX_256 on this machine,
which is better)
how can i use this features for better mdrun speed.
The level of optimization i
Hello,
you need to recompile Gromacs with -DGMX_SIMD=AVX_256 flag. Or not set it and
cmake should detect and use the best version automatically.
http://www.gromacs.org/Documentation/Installation_Instructions_4.6
Cheers.
Milan
On Thursday 23 October 2014 13:32:31 Yaser Hosseini wrote:
> hi
>
>
hi
Reading file md.tpr, VERSION 4.6.5 (single precision)
Using 4 MPI threads
Compiled acceleration: SSE4.1 (Gromacs could use AVX_256 on this machine,
which is better)
how can i use this features for better mdrun speed.
thanke you.
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