[gmx-users] question

Atila Petrosian atila.petrosian at gmail.com
Thu Jul 30 18:28:45 CEST 2015

Dear gromacs users

I want to use LIE to obtain binding free energy for my protein-ligand

Can I use 0.181 and 0.5 as alpha and beta coefficients for my system?

Are 0.181 and 0.5 appropriate for any kind of protein-ligand complex?

Any help will highly appreciated.


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