[gmx-users] Gromacs FEP tutorial

[Justin Lemkul]

On 8/20/19 1:36 PM, Alex Mathew wrote:
> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/gmx-tutorials/free_energy/01_theory.html
>

The protocol in the tutorial is simply the elimination of LJ parameters 
to compute the vdW contribution to free energy of solvation. It is not 
(by design) a complete cycle that computes a full free energy of solvation.

-Justin

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Justin A. Lemkul, Ph.D.
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