AMBER Archive (2009)

Subject: Re: [AMBER] Improper dihedrals between residues?

From: Carlos Simmerling (carlos.simmerling_at_gmail.com)
Date: Tue Jun 09 2009 - 12:51:40 CDT

that's good to note. I'm pretty sure it is just a subset (no center of mass
groups, for example) and can never recall exactly what's there and what's
not.

On Tue, Jun 9, 2009 at 1:14 PM, David A. Case <case_at_biomaps.rutgers.edu>wrote:

> On Tue, Jun 09, 2009, Carlos Simmerling wrote:
>
> > it might be easiest to add this in the dihedral restraint section in the
> NMR
> > restraints. however, this will only work for sander.
>
> I think(?) all the NMR restraint stuff in sander also works in pmemd.
>
> ...dac
>
>
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