Hello,
I want to calculate the deltaG of the polar and non polar contributions.
I was going to use Poisson Boltzmann and Solvent accessible surface
calculations..
I have had a good look through the manuel and think I need to use Sander
and Molsurf.
I wondered if anyone had an example tutorial or command for these (I have
had a look in the manual and am still quite confused)
I have a pdb file of a crystal structure of protein-ligand
Many thanks
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Received on Mon Dec 03 2018 - 08:30:01 PST
