[gmx-developers] Fluctuations printed by mdrun

Berk Hess hess at cbr.su.se
Mon Nov 29 12:47:34 CET 2010


I removed it because it requires storing more history over the whole
system in checkpoint files.
g_energy will print this for you.

Berk

On 11/29/2010 12:03 PM, Christian Mötzing wrote:
> Hi,
>
> in version 4.0.x mdrun printed the fluctuations of a simulation (I am
> doing a waterbox simulation) to the log file.
>
> In version 4.5.x this output is gone and I can't find a way to turn it
> on again.
>
> How do I get this kind of output in 4.5.x?
>
> Thx
>
> Christian
>
>   




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