[gmx-users] question about energy minimization

[Mark Abraham]

On 4/07/2012 5:46 PM, reisingere at rostlab.informatik.tu-muenchen.de wrote:
> Hi everybody,
>
> is there a possibility to define an energy value and when the change of
> the energy between two steps during the minimization is lower than this
> value the minimization is finished?
>

If it's in manual 7.3.5, you can do it.

Mark