AMBER Archive (2008)Subject: Re: AMBER: Convert dcd to mdcrd
From: Vlad Cojocaru (Vlad.Cojocaru_at_eml-r.villa-bosch.de)
Date: Wed Mar 26 2008 - 04:02:38 CDT
Dear Seth,
you can use ptraj to read the dcd and write an mdcrd ....
But why would you want to do that?? The dcd file is ~ half the size and
itis faster to load into visualization software such as VMD ...
Cheers
vlad
Seth Lilavivat wrote:
> Dear Amber users,
>
> Is there an easy way to convert a .dcd (namd trajectory) file to a
> .mdcrd?
>
> Thanks,
> Seth
--
----------------------------------------------------------------------------
Dr. Vlad Cojocaru
EML Research gGmbH
Schloss-Wolfsbrunnenweg 33
69118 Heidelberg
Tel: ++49-6221-533266
Fax: ++49-6221-533298
e-mail:Vlad.Cojocaru[at]eml-r.villa-bosch.de
http://projects.villa-bosch.de/mcm/people/cojocaru/
----------------------------------------------------------------------------
EML Research gGmbH
Amtgericht Mannheim / HRB 337446
Managing Partner: Dr. h.c. Klaus Tschira
Scientific and Managing Director: Prof. Dr.-Ing. Andreas Reuter
http://www.eml-r.org
----------------------------------------------------------------------------
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu
|