Re: Trigger DCD frame from TCL?

From: Brian Radak (
Date: Tue Nov 08 2016 - 09:22:24 CST

I think the DCD standard expects/requires evenly spaced frames, so,
probably not?

A close alternative is the "output <basename>" command, which triggers a
writing of coordinates, velocities, and extended system files based on
the provided basename. It's not pretty, but you can paste together a
bunch of binCoordinate files with catdcd when you are done.



On 11/08/2016 09:12 AM, Norman Geist wrote:
> Hey there,
> is there any TCL command that can be used to trigger a DCD frame,
> without using dcdfreq?

Brian Radak
Postdoctoral Appointee
Leadership Computing Facility
Argonne National Laboratory
9700 South Cass Avenue, Bldg. 240
Argonne, IL 60439-4854
(630) 252-8643

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