[gmx-users] can i put different pressure value on different box side??

[wang kelvin]

thanks Justin very much.

2008/12/30 Justin A. Lemkul <jalemkul at vt.edu>

>
>
> wang kelvin wrote:
>
>> hi ,everyone
>>  i have two questions.
>>  first ,can i put different pressure on differnt box side with GMX?
>>
>>
>
> Yes, read about anisotropic pressure coupling.
>
> second,can i calulate stress or stench with GMX?
>>
>>
>
> Have a look at the "deform" .mdp option.
>
> -Justin
>
> any suggestions is apprciated
>>
>>
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>
> --
> ========================================
>
> Justin A. Lemkul
> Graduate Research Assistant
> Department of Biochemistry
> Virginia Tech
> Blacksburg, VA
> jalemkul[at]vt.edu | (540) 231-9080
> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
>
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