On Thu, May 19, 2005, milion.c-box.cz wrote:
>
> I would ask you what is the most optimal value of dielc in the protein
> interior. I have a problem with setting up the optimal dielc value for GB
> minimization (igb=1).
The recommended value for intdiel (and the only one that has been tested very
much) is 1.0.
....dac
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Thu May 19 2005 - 17:53:00 PDT