[gmx-users] Docking Energy confirmation

[Filipe Maia]

I'm doing docking "calculations" with Autodock3.05.
My question is, is there any way to use the energy minimization procedure 
from
Gromacs to relax the conformations obtained from autodock and have a 
better estimate
of their energy (in comparision tothe energy that autodock gives as 
result)?

-- 
Don't go around saying the world owes you a living.
The world owes younothing.  It was here first.
          -- Mark Twain