AMBER Archive (2003)

Subject: Re: unifying trajectory files

From: Natasja Brooijmans (nbrooij_at_itsa.ucsf.edu)
Date: Wed Jun 25 2003 - 11:25:41 CDT

You can use ptraj

Natasja Brooijmans, Ph.D.
Visiting Post-Doctoral Scholar
Kuntz Laboratory
Department of Pharmaceutical Chemistry
University of California, San Francisco
San Francisco, CA 94143-2240
phone: 415-476 3986
fax: 415-502 1411
e-mail: nbrooij_at_itsa.ucsf.edu

On Wed, 25 Jun 2003, Peter Anderson wrote:

> Dear Amber Users,
>
> I recently ran a 1-ns molecular dynamics simulation
> that crashed a few times throughout the run. I thus
> have several separate .mdcrd and .restrt files. Can
> anyone tell me how I can combine the several
> trajectory files together to get one integrated
> trajectory file, if possible?
>
> Thank you very much,
> Peter Anderson
>
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