Hi,
On Wed, Jun 2, 2021 at 3:47 PM Lambach, Lauren <lauren-lambach.uiowa.edu> wrote:
>
> No matter what I try I can only get 3 decimal places. I would imagine there is a way to print out more decimal places. Does anyone know how I can do this?
This is because the Amber ASCII trajectory format is a fixed 8.3
precision. You can use the 'highprecision' keyword to get 8.6, but be
aware this format is much easier to overflow. If you need an ASCII
format use either Amber restart, mol2, or charmm cor with the 'ext'
keyword for extended precision.
Hope this helps,
-Dan
>
> Thanks in advance,
> Lauren
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Jun 02 2021 - 13:30:02 PDT
