[gmx-users] profiles az a function of z

Justin A. Lemkul jalemkul at vt.edu
Fri Oct 16 22:05:12 CEST 2009



Paymon Pirzadeh wrote:
> Hello,
> In a simulation, how is it possible to extract the profiles e.g.
> potential as a function of z (coordinate axis of box)?
> 

g_potential can do this for electrostatic potential, but I don't know about 
anything else.  I don't think it is a trivial question to decompose the 
potential of the entire system along any axis.

-Justin

> Payman
> 
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-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
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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