[Chimera-users] Step through trajectory from command line?
Eric Pettersen
pett at cgl.ucsf.edu
Mon Mar 3 11:54:49 PST 2008
Hi Kristina,
There is no command for advancing trajectory frames. Perhaps you
can detail the scenario that you need this for and why the per-frame
scripting of the MD Movie tool doesn't cover your needs. Are you
trying to completely automate the production of a movie from a
trajectory or some such?
Even if there were a command to advance the trajectory, how would
you know when to stop? There are no "flow control" statements (if
statements/for loops/functions) in the Chimera command language. I
think you will have to use Python scripting for completely automating
trajectory-related scripting. I can provide assistance there.
--Eric
Eric Pettersen
UCSF Computer Graphics Lab
http://www.cgl.ucsf.edu
On Feb 29, 2008, at 10:18 AM, Kristina Furse wrote:
> Hi-
>
> Can you advance a trajectory by one frame from the command line, or
> do you have
> to use the controls in the MD Movie panel?
>
> Thanks,
> Kristina
>
> --
> Kristina Furse
> Postdoctoral Research Associate
> 262 Stepan Chemistry Hall
> Notre Dame, IN 46556
> (574)631-3904
>
>
>
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> Chimera-users at cgl.ucsf.edu
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