Re: [AMBER] Error due to ***s in restart file

From: Arvind <bahuroopi.gmail.com>
Date: Thu, 23 Sep 2010 00:02:44 +0530

Hello Trevor,

On Wed, Sep 22, 2010 at 10:46 AM, Trevor Gokey <tgokey.mail.sfsu.edu> wrote:
> Hello,
>
> My work-around to the 0 velocity issue is to create a reimaged restart file from the last frame in the trajectory and then copying the velocities from the original restart to the new restart. This assumes ntwx and ntwr have the same value.

That is an effective solution - should have thought about it myself.
Will try that.

thanks,
arvind

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Received on Wed Sep 22 2010 - 12:00:04 PDT
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