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CCL
August 23, 2007
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An archive of computation chemistry related software
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An archive of all past messages on the ccl mailing list
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Collections of data sets of use to computational chemists
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Collections of faq's and other documentation for various different programs
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From:
"Tamas Gunda" <tgunda1%%puma.unideb.hu>
Date:
Wed, 22 Aug 2007 17:38:08 +0200
Subject:
CCL: Fractional coordinates to cartesian
From:
Szabolcs Csepregi <scsepregi!A!chemaxon.com>
Date:
Thu, 23 Aug 2007 08:45:55 +0200
Subject:
CCL: Looking for freeware to compute Tanimoto coefficient
From:
Lothar Terfloth <lothar.terfloth _ chemie.uni-erlangen.de>
Date:
Wed, 22 Aug 2007 18:00:43 +0200
Subject:
CCL: Open Source 3D coordinate generation tool
From:
"Rzepa, Henry" <h.rzepa_._imperial.ac.uk>
Date:
Thu, 23 Aug 2007 11:15:21 +0100
Subject:
CCL: GIAO Magnetic shielding tensor for C-Br systems: an anomaly?
From:
"Abraham George" <abraham.mankavil^^gmail.com>
Date:
Wed, 22 Aug 2007 22:26:07 +0530
Subject:
CCL: research
From:
"Alessandro Contini (alessandro.contini)" <alessandro.contini]_[unimi.it>
Date:
Thu, 23 Aug 2007 13:13:32 +0200
Subject:
CCL: GIAO Magnetic shielding tensor for C-Br systems: an anomaly?
From:
Martin Kaupp <kaupp ~~ mail.uni-wuerzburg.de>
Date:
Thu, 23 Aug 2007 13:15:36 +0200
Subject:
CCL:G: GIAO Magnetic shielding tensor for C-Br systems: an anomaly?
From:
chupvl <chupvl~~gmail.com>
Date:
Thu, 23 Aug 2007 13:07:01 +0400
Subject:
CCL: Looking for freeware to compute Tanimoto coefficient
From:
James Asher <asher:+:mail.uni-wuerzburg.de>
Date:
Thu, 23 Aug 2007 04:33:54 +0200
Subject:
CCL:G: ADMP initial velocities
From:
Rajarshi Guha <rguha[-]indiana.edu>
Date:
Wed, 22 Aug 2007 22:38:32 -0400
Subject:
CCL: Looking for freeware to compute Tanimoto coefficient
From:
"Mesa Analytics & Computing, LLC" <mesaac**comcast.net>
Date:
Thu, 23 Aug 2007 06:54:21 -0600
Subject:
CCL: Looking for freeware to compute Tanimoto coefficient
From:
"Igor Filippov [Contr]" <igorf(-)helix.nih.gov>
Date:
Thu, 23 Aug 2007 10:49:28 -0400
Subject:
CCL: Looking for freeware to compute Tanimoto coefficient
From:
"Alexandra Tavares Marques" <alexandra.marques|-|fc.up.pt>
Date:
Thu, 23 Aug 2007 11:13:03 -0400
Subject:
CCL:G: ONIOM problem
From:
"Efrat Noy" <enoy]^[epixpharma.com>
Date:
Thu, 23 Aug 2007 11:24:40 -0400
Subject:
CCL: fragment-substructure search
From:
david.giesen!^!kodak.com
Date:
Thu, 23 Aug 2007 08:34:22 -0400
Subject:
CCL: GIAO Magnetic shielding tensor for C-Br systems: an anomaly?
From:
"Aviva Litovitz" <ael23,,cornell.edu>
Date:
Thu, 23 Aug 2007 14:28:32 -0400
Subject:
CCL:G: ADMP initial velocities
From:
Joseph Durant <jdurant.(~).mdl.com>
Date:
Thu, 23 Aug 2007 11:26:33 -0700
Subject:
CCL: fragment-substructure search
From:
"TJ O'Donnell" <tjo]~[acm.org>
Date:
Thu, 23 Aug 2007 13:51:51 -0700 (PDT)
Subject:
CCL: fragment-substructure search
From:
"Green Power" <powergreen.{}.gmail.com>
Date:
Thu, 23 Aug 2007 16:58:26 -0400
Subject:
CCL: Semi empirical PBC program