Re: [AMBER] Is this output OK from the hybrid remd?

From: Carlos Simmerling <>
Date: Mon, 20 Dec 2010 12:36:41 -0500

We are looking into this because you have a message about wrapping and
probably should not. Give us a day or two to track it down.

On Dec 20, 2010 12:31 PM, "Bongkeun Kim" <> wrote:

Quoting Jason Swails <>:

> If you just switched reference coordinates without re-running the
> equilibration and such subject...
I used a single reference structure during the equilibration md which
is gr3252_min2.rst. Only thing I did is I changed the reference
structure from each final output of eq md for each replica to this

Thank you.
Bongkeun Kim

> Good luck,
> Jason
> On Sun, Dec 19, 2010 at 2:02 PM, Bongkeun Kim <bki...
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Received on Mon Dec 20 2010 - 10:00:11 PST
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