Re: velocities

From: David A. Case <case.scripps.edu>
Date: Mon, 10 Mar 2003 08:04:58 -0800

On Mon, Mar 10, 2003, sara nunez wrote:
>
> I wrote a while ago to the forum, but obtained no response from anyone. I
> would like to know if it is possible to extract the velocity of just a
> single atom from the mdvel file along the trajectory.

You could set mdvel to save all the velocities, then examine that file to
find the atom you want. (I don't remember seeing your earlier mail.)

...dac 

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David A. Case                     |  e-mail:      case.scripps.edu
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Received on Mon Mar 10 2003 - 16:53:01 PST
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