[gmx-users] Re: Choosing more PMF-windows

Shay Teaching shay.teaching at gmail.com
Sun Jul 31 14:36:31 CEST 2011


P.S.
Using gromacs 4.0.7

On Sun, Jul 31, 2011 at 5:36 AM, Shay Teaching <shay.teaching at gmail.com>wrote:

> Dear GROMACS users,
>
> I have recently completed running several PMF-windows.
> After viewing the histrogram file it seems that I need better sampling at
> some positions, but the histogram file starts at z=0.
> Is there any way to prevent g_wham from starting at 0, and instead show the
> real Z-coordinates of the selected-group?
>
> Regards,
> -Shay
>
>
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