CCL Home

Up Directory CCL March 6, 2003

Previous day Month index Next day

From:  "Mingyue Zheng" <myzheng : at : mail.shcnc.ac.cn>
Date:  Thu, 6 Mar 2003 10:49:53 +0800
Subject:  Can Autodock3.0 reckon iron in?

From:  bllin-: at :-mail.ustc.edu.cn
Date:  Thu, 6 Mar 2003 19:29:11 +0800 (CST)
Subject:  Convergence problem in the single-point calculations of Gaussian 98

From:  "Jens Spanget-Larsen" <spanget "-at-" virgil.ruc.dk>
Date:  Thu, 6 Mar 2003 08:37:03 +0100
Subject:  CCL:NBO Analysis

From:  Charles Xie <qxie.,at,.concord.org>
Date:  Thu, 06 Mar 2003 09:20:27 -0500
Subject:  Energy conservation of molecular dynamics in the presence of

From:  "Stephan Tatzel" <Stephan.Tatzel-0at0-po.uni-stuttgart.de>
Date:  Thu, 6 Mar 2003 10:41:32 +0100
Subject:  Re: CCL:Can Autodock3.0 reckon iron in?

From:  "Dr. Andreas Klamt" <andreas.klamt-0at0-cosmologic.de>
Date:  Thu, 06 Mar 2003 15:50:49 +0100
Subject:  Full description of SDF file format

From:  "Madison, Vincent" <vincent.madison ( ( at ) ) spcorp.com>
Date:  Thu, 6 Mar 2003 09:29:08 -0500
Subject:  James Kaminski

From:  Szilveszter Juhos <szilva.,at,.ribotargets.com>
Date:  Thu, 6 Mar 2003 16:32:36 +0000 (GMT)
Subject:  Re: CCL:Full description of SDF file format

From:  "David A. Case" <case' at 'scripps.edu>
Date:  Thu, 6 Mar 2003 09:20:21 -0800
Subject:  Re: CCL:Energy conservation of molecular dynamics in the presence of electrostatic forces

From:  Charles Xie <qxie "-at-" concord.org>
Date:  Thu, 06 Mar 2003 12:47:05 -0500
Subject:  Re: CCL:Energy conservation of molecular dynamics in the

From:  "sergey i. kotelevskii" <kotelevskiy &$at$& univer.kharkov.ua>
Date:  Thu, 6 Mar 2003 18:36:01 +0200
Subject:  RE: infra-red stretching frequencies

From:  M Brunsteiner <m.brunsteiner %! at !% ucl.ac.uk>
Date:  Thu, 06 Mar 2003 17:37:38 +0000
Subject:  Re: CCL:Energy conservation of molecular dynamics in the presence

From:  graham.mullier ^at^ syngenta.com
Date:  Thu, 6 Mar 2003 16:50:48 -0000
Subject:  RE: Full description of SDF file format

From:  Konrad Hinsen <hinsen ( ( at ) ) cnrs-orleans.fr>
Date:  Thu, 6 Mar 2003 18:11:12 +0100
Subject:  Re: CCL:Energy conservation of molecular dynamics in the presence of electrostatic forces

From:  carolina lorena <cmascayano_98 (- at -) yahoo.com>
Date:  Thu, 6 Mar 2003 10:37:57 -0800 (PST)
Subject:  database frag to LUDI

From:  Richard Gillilan <reg8(-(at)-)cornell.edu>
Date:  Thu, 06 Mar 2003 13:18:05 -0500
Subject:  Re: CCL:Energy conservation of molecular dynamics in the presence

From:  Konrad Hinsen <hinsen(-(at)-)cnrs-orleans.fr>
Date:  Thu, 6 Mar 2003 20:21:11 +0100
Subject:  Re: CCL:Energy conservation of molecular dynamics in the presence of electrostati