Subject: CCL:Molecular viewing software (fwd)

From: [email-masked] (James Vito)
Date: Tue, 17 May 1994 21:50:03 -0700 (PDT)

JMR might also fit your needs...
location:
Oak.Oakland.Edu
/pub/msdos/chemstry
jmr.zip

Jim Vito
[email-masked]

Forwarded message:
> From [email-masked] Sat May 14 16:20:26 1994
> From: Jan Labanowski <[email-masked]>
> Date: Sat, 14 May 1994 18:14:32 -0400
> Message-Id: <[email-masked]>
> To: [email-masked]
> Subject: CCL:Molecular viewing software
> In-Reply-To: Mail from 'Craig Wilson <[email-masked]>'
>       dated: Sat, 14 May 94 14:36:42 BST
> Cc: [email-masked]
> Sender: [email-masked]
> Errors-To: [email-masked]
> Precedence: bulk
> 
> Craig,
> 
> Craig Wilson <[email-masked]> writes:
> > I would very much like to obtain a good piece of software for displaying 
> > molecular structures from my ab initio calculations. Ideally, the program
> 
> Write yourself a simple perl/awk script which will extract coordinates
> from your ab initio output file and produce XYZ file for Xmol (Xmol
> is available from ftp.msc.edu in /pub/xmol as far as I remember).
> 
> Examples of perl scripts which extract data from output files
> of some ab initio programs are on anonymous ftp on www.ccl.net
> in /pub/chemistry/software/perl/geom
> 
> Jan Labanowski
> [email-masked]
> 
> P.S.  Always give your e-mail address in the signature of your message.
> In your case, the From: address of your message is messed up (though the
> Reply-To: is OK). If people wanted to answer your message directly to you,
> they may have a problem.
> 
> 
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