VMD-L Mailing List

From: John Stone (johns_at_ks.uiuc.edu)
Date: Mon Jun 23 2003 - 09:37:34 CDT

Hi,
  This message bounced this morning so I'm forwarding it to VMD-L
manually (anti-spam measure ate Mark's post):

----- Forwarded message from owner-vmd-l_at_ks.uiuc.edu -----

From: "Storr, Mark" <Mark.Storr_at_nrc-cnrc.gc.ca>
To: "'Shantipriya Tenneti '" <dl_poly_shanti_at_lycos.com>,
   "'vmd-l_at_ks.uiuc.edu '" <vmd-l_at_ks.uiuc.edu>
Subject: RE: .XYZ File format
Date: Mon, 23 Jun 2003 03:35:02 -0400

 Hi,

the last time I looked at DL_POLY there were two programs included with the
program to convert HHISTORY files to XYZ format. These programs were
included in the DL_POLY utilities directory and are called hisxyz.f and
dlpxyz.f both of which were written by Bill Smith the main author of
DL_POLY.
Hope this helps.

Cheers

Mark
> -----Original Message-----
> From: Shantipriya Tenneti
> To: vmd-l_at_ks.uiuc.edu
> Sent: 6/20/03 7:04 PM
> Subject: .XYZ File format
>
> Hi,
>
> There must be so many experienced programmers familiar with VMD &
> DL_POLY in here.
> I want to convert DL_POLY files to .XYZ or .PDB file format to see them
> on VMD.
>
> The author of DL_POLY has not written the code for the conversion to
> .XYZ format which is present in
> DL_POLY 2.13 So he couldnt throw much insight on the program.
> Could someone please help me. I need help as soon as possible.
>
> Regards.
> Shanti
>
> ----- End forwarded message ----- 

-- 
NIH Resource for Macromolecular Modeling and Bioinformatics
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Email: johns_at_ks.uiuc.edu                 Phone: 217-244-3349              
  WWW: http://www.ks.uiuc.edu/~johns/      Fax: 217-244-6078