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CCL
April 23, 2008
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An archive of computation chemistry related software
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Collections of faq's and other documentation for various different programs
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From:
"Lekpa Duukori" <duukori__gmail.com>
Date:
Wed, 23 Apr 2008 09:57:54 +0200
Subject:
CCL:G: problems with a transition state
From:
Herbert Fruchtl <herbert.fruchtl|a|st-andrews.ac.uk>
Date:
Wed, 23 Apr 2008 09:29:04 +0100
Subject:
CCL:G: Gaussian 03 SCF converge problem.
From:
<grog[a]netsons.org>
Date:
Wed, 23 Apr 2008 12:10:59 +0200
Subject:
CCL: Linear dependency in TurboMole
From:
"TJ O Donnell" <tjo-,-gnova.com>
Date:
Tue, 22 Apr 2008 10:53:35 -0400
Subject:
CCL: How to implement your own Daylight or MACCS fingerprint?
From:
"Ross Walker" <ross^rosswalker.co.uk>
Date:
Tue, 22 Apr 2008 21:45:29 -0700
Subject:
CCL:G: UV-Vis spectra prediction
From:
"Gonzalo Jimenez-Oses" <gjimenez%%unizar.es>
Date:
Wed, 23 Apr 2008 13:02:18 -0400
Subject:
CCL: low-spin versus high-spin complexes --SUMMARY--
From:
Oluwakemi.Oloba:-:mail.uh.edu
Date:
Wed, 23 Apr 2008 13:48:16 -0500
Subject:
CCL:G: basis set