Re: [AMBER] Theorical ramachandran map/energy map of modified residues

From: Carlos Simmerling <carlos.simmerling.gmail.com>
Date: Fri, 16 Nov 2012 12:45:50 -0500

ther easiest way is probably to use leap's "impose" command for the
dihedrals.

On Fri, Nov 16, 2012 at 12:25 PM, Baptiste Legrand <bap.legrand.gmail.com>wrote:

> Dear all,
>
> I'm searching a protocol/tutorial to explore the torsion angles that can
> adopt a non-natural residue with amber (I'm not a specialist of these
> kind of calculations). Is there a particular routine to rotate step by
> step the phi and psi angles and to design an energy map? Thanks.
>
> Regards,
> Baptiste
>
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Received on Fri Nov 16 2012 - 10:00:02 PST
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