VMD-L Mailing List
From: John Stone (johns_at_ks.uiuc.edu)
Date: Tue Jun 29 2004 - 13:52:45 CDT
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- In reply to: Xu Zhiping: "PBCWrap for Gromacs?"
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Dear Xu,
Axel Kohlmeyer kindly provided an updated version of Jan's
script that should work with Gromacs files. I haven't personally
tried it yet, but he just posted it on VMD-L a few days ago:
http://www.ks.uiuc.edu/Research/vmd/mailing_list/vmd-l/2974.html
The script itself is here:
http://www.ks.uiuc.edu/Research/vmd/mailing_list/vmd-l/att-2974/pbcwrap.tcl
John Stone
vmd_at_ks.uiuc.edu
On Tue, Jun 29, 2004 at 08:19:33PM +0800, Xu Zhiping wrote:
> Dear All:
> I found that the script is for NAMD xst file, and how about the
> Gromacs trr/xtc file?
>
> Best,
> ZP
> ---------------------------------------------
> Xu ZhiPing
> Ph.D Candidate
> Office: 3-405
> Tel : +86-10-627-83814
> Department of Enginnering Mechanics
> Tsinghua University
> Beijing, CHINA, 100084
> ---------------------------------------------
-- NIH Resource for Macromolecular Modeling and Bioinformatics Beckman Institute for Advanced Science and Technology University of Illinois, 405 N. Mathews Ave, Urbana, IL 61801 Email: johns_at_ks.uiuc.edu Phone: 217-244-3349 WWW: http://www.ks.uiuc.edu/~johns/ Fax: 217-244-6078
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