Re: AMBER: fragment parametrization tutorial?

From: Carlos Simmerling <carlos.simmerling.gmail.com>
Date: Sat, 29 Sep 2007 17:48:30 -0400

how about
*Simulating a Solvated Protein that Contains Non-Standard Residues*
http://www.rosswalker.co.uk/tutorials/amber_workshop/Tutorial_four/


On 9/29/07, Miguel Ortiz-Lombardía <ibdeno.gmail.com> wrote:
>
> Dear amber users,
>
> I want to carry out binding free energy calculations for a system where
> one protein contains a non-standard residue, N(6)-acetyl-lysine. Since I
> haven't been able to locate parameters for such residue, I'd like to try and
> generate them myself. Being quite new to AMBER, I'd appreciate if someone
> could point me to a tutorial for this kind of procedure within AMBER.
>
> Thanking you in advance for your help,
>
>
> Miguel
> --
> correo-e: ibdeno.gmail.com
> ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
> Je suis de la mauvaise herbe,
> Braves gens, braves gens,
> Je pousse en liberté
> Dans les jardins mal fréquentés!
>
> Georges Brassens
>

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Received on Sun Sep 30 2007 - 06:07:56 PDT
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