[gmx-users] Warning: Pressure scaling more than 1%.

Pawan Kumar pawan.chinari at gmail.com
Mon May 11 09:30:06 CEST 2009


Hi,

Increasing the tau-p value in the parameter file should help.

Regards,
Pawan

On Mon, May 11, 2009 at 11:06 AM, Zhanglin Ni <zlni at u.washington.edu> wrote:

> Dear all,
> when I run position-restrained simulation (total 15000steps). when it
> reached 740 steps
> Step 741  Warning: Pressure scaling more than 1%.
>
> Step 742  Warning: Pressure scaling more than 1%.
>
> Step 743  Warning: Pressure scaling more than 1%.
>
> Step 744  Warning: Pressure scaling more than 1%.
>
> Step 745  Warning: Pressure scaling more than 1%.
>
> Step 746  Warning: Pressure scaling more than 1%.
>
> Step 747  Warning: Pressure scaling more than 1%.
>
> Step 748  Warning: Pressure scaling more than 1%.
>
> I knew the error was shown in the Gromacs websites. But after I read those,
> I still donot know how to solve it. any one give some clue. Thanks
> Johnny
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