CCL Home
http://server.ccl.net/cgi-bin/ccl/day-index.cgi?2008+11+13

Up Directory CCL November 13, 2008
Software Archive
An archive of computation chemistry related software,
List Archive
An archive of all past messages on the ccl mailing list,
Data Archives
Collections of data sets of use to computational chemists,
Document Archives
Collections of faq's and other documentation for various different programs,
Search CCL
Text Search,

Previous day Month index Next day

From:  Stan van Gisbergen <vangisbergen]=[scm.com>
Date:  Thu, 13 Nov 2008 08:29:44 +0100
Subject:  CCL: DOS Density of States ??

From:  Ramon Crehuet <rcsqtc%%iiqab.csic.es>
Date:  Thu, 13 Nov 2008 12:32:59 +0100
Subject:  CCL: ORCA and MPI

From:  "John McKelvey" <jmmckel()gmail.com>
Date:  Thu, 13 Nov 2008 07:37:50 -0500
Subject:  CCL: ORCA and MPI

From:  "Mihaly Mezei" <Mihaly.Mezei^-^mssm.edu>
Date:  Wed, 12 Nov 2008 13:34:23 -0500
Subject:  CCL: Zn2+ - CYS covalent bond parameters

From:  Mikko Vainio <mikko.vainio-$-abo.fi>
Date:  Wed, 12 Nov 2008 16:32:10 +0200
Subject:  CCL: MPI

From:  "Mehdi Davari" <mehdi.davari---gmail.com>
Date:  Wed, 12 Nov 2008 23:44:05 +0330
Subject:  CCL: Self Consistent Field (SCF) method before Hartree

From:  "John McKelvey" <jmmckel++gmail.com>
Date:  Thu, 13 Nov 2008 10:03:42 -0500
Subject:  CCL: MPI

From:  Ramon Crehuet <rcsqtc*iiqab.csic.es>
Date:  Thu, 13 Nov 2008 13:32:27 +0100
Subject:  CCL: Orca and float/double

From:  "John McKelvey" <jmmckel[*]gmail.com>
Date:  Thu, 13 Nov 2008 12:38:51 -0500
Subject:  CCL: Running ORCA in parallel

From:  "Peter Bladon" <cbas25,+,strath.ac.uk>
Date:  Thu, 13 Nov 2008 13:00:18 -0500
Subject:  CCL: Windows command for selecting a processor

From:  Rick Venable <venabler++nhlbi.nih.gov>
Date:  Thu, 13 Nov 2008 13:46:26 -0500
Subject:  CCL: Zn2+ - CYS covalent bond parameters

From:  "Ol Ga" <eurisco1-x-pochta.ru>
Date:  Thu, 13 Nov 2008 15:07:44 -0500
Subject:  CCL: Running ORCA in parallel: not an answer, but reasonable advice

From:  Daniel Jana <dfjana[*]gmail.com>
Date:  Thu, 13 Nov 2008 21:29:41 +0100
Subject:  CCL: ORCA and MPI

From:  Frank Neese <neese===thch.uni-bonn.de>
Date:  Thu, 13 Nov 2008 20:26:38 +0100
Subject:  CCL: Orca and float/double

From:  "Oleg Trott" <trott(a)scripps.edu>
Date:  Thu, 13 Nov 2008 13:46:45 -0800
Subject:  CCL: Video Tutorial: Docking using Vina with AutoDock Tools and PyMOL

From:  "Mr Shabbir" <shabbir,nenu.edu.cn>
Date:  Thu, 13 Nov 2008 22:50:47 -0500
Subject:  CCL: NMR shielding Effects

From:  "simpananmaklumat bahan" <simpananmaklumat]~[gmail.com>
Date:  Fri, 14 Nov 2008 11:43:43 +0800
Subject:  CCL: =?UTF-8?Q?=E2=88=86E_problem?=