On Wed, Aug 10, 2011, Catein Catherine wrote:
>
> Based on literature and tutorial in AMBER webpage, I found GBSA parameters are as follows in general:
> I have tried to read the manual, but I still cannot figure it out.
The manual (tries to) explain *how* to run Amber jobs, but cannot explain all
the science. But it does give many references to papers about GB theory, see
p. 53. I'm biased, but I think ref. [49] is a pretty good starting point.
....dac
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Received on Thu Aug 11 2011 - 09:00:03 PDT
