AMBER Archive (2005)

Subject: Re: AMBER: GB and mm_pbsa.pl

From: David A. Case (case_at_scripps.edu)
Date: Wed Apr 20 2005 - 12:18:35 CDT

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

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu