AMBER Archive (2008)

Subject: Re: AMBER: NMR refinement

From: David A. Case (
Date: Fri Jan 18 2008 - 11:35:37 CST

On Fri, Jan 18, 2008, David A. Case wrote:

I missed one other thing:

> On Thu, Jan 17, 2008, Wenyong Tong wrote:
> >
> > igb=1, saltcon=0.05, offset=0.13,

Why are you setting your own offset??? I would guess that this would mess
up the GB energetics of your system quite a bit. Changing this from the
default value is certainly a very advanced step -- was this recommended to you
for sugars or something?


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