Re: [AMBER] How to generate inputfile

From: David Case <david.case.rutgers.edu>
Date: Fri, 17 Mar 2017 09:12:57 -0500

On Fri, Mar 17, 2017, 杨满意 wrote:

> Se from S. The follwoing is vdW parameters for S, How about Se.
> s 1.9825 0.2824

See below; I personally don't know the answer.

> The vdW parameters will have a great influence on our MD results?

Yes.

> Sorry, I still cannot understanding this sentence: "There are several
> force fields available that cover the entire periodic table"

Did you try a Google search on something like "force field entire periodic
table"?

....dac


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Received on Fri Mar 17 2017 - 07:30:03 PDT
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