Re: AMBER: N-terminal Arg charges in ff99 not 1.00

From: Guanglei Cui <cuigl.csb.sunysb.edu>
Date: Wed, 30 Jun 2004 17:13:55 -0400

What version of amber are you using? For amber8, "charge NARG" gives me
2.00 ...

Guanglei

Michael Dolan wrote:

> Hello Ambers,
>
> I've noticed that the total charge for a charged N-terminal Arginine is
> 0.9764. Can someone explain why it is not 1.00? The total charge of the
> Arg and it's terminal blocking group is 1.9764.
>
> Thank you,
>
> Mike
>
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Received on Wed Jun 30 2004 - 22:53:00 PDT
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