Re: AMBER: GB and mm_pbsa.pl

From: David A. Case <case.scripps.edu>
Date: Wed, 20 Apr 2005 10:18:35 -0700

On Wed, Apr 20, 2005, Nelson Fonseca wrote:
>
> Could you give me some references for the Gnp parameters
> for DMSO? SURFTEN and SURFOFF?

I have no clue....trying to set up surface-dependent "hydrophobic" parameters
for DMSO would probably be a real challenge. Are you sure you understand that
you are not proposing any sort of standard calculation?

....dac

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Received on Wed Apr 20 2005 - 18:53:01 PDT
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