[gmx-users] LIE method

[Tatiana de Arruda Campos Brasil de Souza]

Dear users, 

I want to estimate the affinity of a protein to two diferent ligands and 
compare the results. Is the LIE the best method to do that? Does any one 
have a reference that this kind of analysis is performed or an example of 
mdp? 

Best regards,

Tatiana