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CCL
March 12, 2009
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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:
"Soumya Samineni" <soumya_samineni]^[rediffmail.com>
Date:
Thu, 12 Mar 2009 01:22:39 -0400
Subject:
CCL: Computational Chemistry - Arm chair Scientists !!!
From:
Chris Dickson <c.n.dickson+/-sms.ed.ac.uk>
Date:
Thu, 12 Mar 2009 03:34:55 +0000 (GMT)
Subject:
CCL:G: IR spectra from Gaussian
From:
Daniil Bratashov <dn2010/./gmail.com>
Date:
Thu, 12 Mar 2009 10:11:09 +0300
Subject:
CCL:G: IR spectra from Gaussian
From:
Narendra <narendrax++gmail.com>
Date:
Thu, 12 Mar 2009 14:02:49 +0530
Subject:
CCL:G: IR spectra from Gaussian
From:
"Shuwen Yao" <lilichemistry++yahoo.com>
Date:
Thu, 12 Mar 2009 04:38:19 -0400
Subject:
CCL: P electrons distribution among the three P orbitals
From:
Michel Petitjean <petitjean.chiral{:}gmail.com>
Date:
Thu, 12 Mar 2009 09:24:42 +0100
Subject:
CCL: Computational Chemistry - Arm chair Scientists !!!
From:
"=?utf-8?B?bHl6aGFv?=" <lyzhao{}zjnu.cn>
Date:
Thu, 12 Mar 2009 17:06:51 +0800
Subject:
CCL: =?utf-8?B?UmU6IENDTDpHOiBJUiBzcGVjdHJhIGZyb20gR2F1c3NpYW4=?=
From:
lerouvin:loria.fr
Date:
Thu, 12 Mar 2009 14:13:18 +0100
Subject:
CCL: Computational Chemistry - Arm chair Scientists !!!
From:
"Volker Haehnke" <haehnke-$-bioinformatik.uni-frankfurt.de>
Date:
Thu, 12 Mar 2009 07:02:24 -0400
Subject:
CCL: Simulating 1H NMR Spectra
From:
"Serdar Badoglu" <sbadoglu#gazi.edu.tr>
Date:
Thu, 12 Mar 2009 03:43:28 -0400
Subject:
CCL:G: IR spectra from Gaussian
From:
"Roman D Gorbunov" <rgorbuno:_:aecom.yu.edu>
Date:
Thu, 12 Mar 2009 10:37:15 -0400
Subject:
CCL:G: Error imposing constraints in Gaussian
From:
"Yutao Yue" <Yutao.Yue : gmail.com>
Date:
Thu, 12 Mar 2009 10:54:53 -0400
Subject:
CCL:G: (correction) Energy change upon swapping two orbitals in Gaussian 98
From:
"Richard Tia" <richtiagh^gmail.com>
Date:
Thu, 12 Mar 2009 12:17:36 -0400
Subject:
CCL: Pi complex vrs reactants
From:
"Johannes Hachmann" <jh388 . cornell.edu>
Date:
Thu, 12 Mar 2009 12:50:56 -0400
Subject:
CCL:G: (correction) Energy change upon swapping two orbitals in Gaussian 98
From:
Rene Fournier <renef(-)yorku.ca>
Date:
Thu, 12 Mar 2009 10:55:04 -0500 (EST)
Subject:
CCL: Computational Chemistry - Arm chair Scientists !!!
From:
Patricia Richardson <Patricia.Richardson~~ed.ac.uk>
Date:
Thu, 12 Mar 2009 13:31:12 +0000
Subject:
CCL:G: IR spectra from Gaussian
From:
Tanja van Mourik <tanja.vanmourik~!~st-andrews.ac.uk>
Date:
Thu, 12 Mar 2009 19:32:58 +0000
Subject:
CCL: Pi complex vrs reactants
From:
"Jim Kress" <ccl_nospam _ kressworks.com>
Date:
Thu, 12 Mar 2009 15:07:12 -0400
Subject:
CCL: Computational Chemistry - Arm chair Scientists !!!
From:
Yutao Yue <yutao.yue%gmail.com>
Date:
Thu, 12 Mar 2009 15:15:59 -0400
Subject:
CCL:G: (correction) Energy change upon swapping two orbitals in Gaussian 98