[gmx-users] free energy

Justin A. Lemkul jalemkul at vt.edu
Sun Mar 14 19:05:50 CET 2010

afsaneh maleki wrote:
> Hi,
> I inserted the protein in bilayer at Z normal and simulated membrane 
> protein. to calculate free energy, it is better to use "umbrella 
> sampling tutorial " from Justin Lemkul or "free energy tutorial" from 
> David Mobley for my system? 

That depends entirely upon the process you want to study.  What free energy do 
you want?


> thanks,
> Afsaneh


Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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