[gmx-users] How to calculate PMF after AFM pulling

[Justin A. Lemkul]

huifang liu wrote:
> Hello everybody,
>  
> I have recently run a SMD with AFM method, and i got the .pdo file. But 
> i don't know how to use the .pdo file to calculate the PMF profile. 
> Could someone give me some suggestion? Thanks a lot.
>  

g_wham -h

-Justin

> Huifang
> 
> -- 
> Huifang Liu (Ph.D. Student)
> School of Pharmacy
> Fudan University
> 
> 138 Yi Xue Yuan Rd.          Tel: (86-21)54237419 (O)
> Shanghai, China, 200032     Cell phone: +86-13764669357
> E-mail: huifangliu1985 at gmail.com <mailto:huifangliu1985 at gmail.com> Fax: 
> (86-21)54237264
> 
> 
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-- 
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Justin A. Lemkul
Graduate Research Assistant
ICTAS Doctoral Scholar
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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