[gmx-users] Gibbs free energy of binding

[Justin A. Lemkul]

shahab shariati wrote:
> Hi gromacs users
>  
> Can I use gromacs for obtaining Gibbs free energy of binding of protein 
> and dna?
> 

Yes.  I would suggest you read about potential of mean force calculations.

-Justin

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Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
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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