Re: [AMBER] Terminal O5'/O3' for nucleosides in ff86?

From: David A Case <>
Date: Thu, 3 Dec 2020 08:57:40 -0500

On Wed, Dec 02, 2020, Kenneth Huang wrote:
>This might be something of a long shot since I'm digging deep into
>history here, but does anyone know how ff86 handles nucleosides? I'm
>doing an exercise to see how close I can feasibly get to the nucleoside
>charges in ff94 by Cieplak et al's paper....

I don't have an answer to your question, but you might ask at the R.E.D.
website. Francois spent a lot of time trying to reproduce the old
charges, and *might* have some insight here.


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Received on Thu Dec 03 2020 - 06:00:04 PST
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