[gmx-users] About the evaluation for the free energy of lipid/protein interacion

[Mark Abraham]

Shulin Zhuang wrote:
> Dear All,
>  
> Here, Can the gromacs be used to evaluate the free energy of 
> lipid/protein interacion in biological membranes?

No, but you can estimate free energy changes.

>  If can, How to do 
> that? 

Please start by looking in the manual.

Mark