From owner-chemistry@ccl.net Thu Jan  8 01:52:01 2009
From: "Karin Wichmann wichmann]^[cosmologic.de" <owner-chemistry%%server.ccl.net>
To: CCL
Subject: CCL: COSMOtherm / COSMO-RS Training
Message-Id: <-38401-090107081903-24258-TgiT94VD3CdeBrarOhPGYw%%server.ccl.net>
X-Original-From: Karin Wichmann <wichmann]|[cosmologic.de>
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Date: Wed, 07 Jan 2009 13:39:58 +0100
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Sent to CCL by: Karin Wichmann [wichmann##cosmologic.de]

COSMOlogic has a small number of seats available for a free COSMOtherm
training on January 29. The training is a one-day course covering
COSMO-RS theory for fluid thermodynamics and its applications in the
areas of chemical engineering and life science. The course will take
place at our  location in Leverkusen (Germany).

For further information please contact us at cosmotherm (AT) cosmologic.de

-- 
------------------------
Dr. Karin Wichmann
COSMOlogic GmbH & Co. KG
Burscheider Str. 515
D-51381 Leverkusen
Germany
Phone   +49-2171-73168-3
Fax     +49-2171-73168-9
------------------------


From owner-chemistry@ccl.net Thu Jan  8 08:42:01 2009
From: "Roland H Lindh roland.lindh^^^teokem.lu.se" <owner-chemistry.@.server.ccl.net>
To: CCL
Subject: CCL: The 5th MOLCAS workshop
Message-Id: <-38402-090108044427-22638-vaADh1p6tts1flTvXY1adg.@.server.ccl.net>
X-Original-From: "Roland H Lindh" <roland.lindh[*]teokem.lu.se>
Date: Thu, 8 Jan 2009 04:44:23 -0500


Sent to CCL by: "Roland H Lindh" [roland.lindh~~teokem.lu.se]
Dear Friends,
 the 5th MOLCAS workshop will take place May 4-8 2009 at Minneapolis, MN, USA. For more information check:

http://www.ima.umn.edu/2008-2009/SW5.4-8.09/

Take care,

-roland (roland.lindh_+_teokem.lu.se)


From owner-chemistry@ccl.net Thu Jan  8 09:17:01 2009
From: "Vincent Leroux vincent.leroux(~)loria.fr" <owner-chemistry.@.server.ccl.net>
To: CCL
Subject: CCL: MD code
Message-Id: <-38403-090108084322-14363-aUjhZwSqjs+q/vte+kBStw.@.server.ccl.net>
X-Original-From: Vincent Leroux <vincent.leroux=-=loria.fr>
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Date: Thu, 08 Jan 2009 14:43:02 +0100
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Sent to CCL by: Vincent Leroux [vincent.leroux[#]loria.fr]
Hi Leyla,
TINKER might contain the routines you need... 
http://dasher.wustl.edu/tinker/
You should also take a look at http://www.nr.com/ - if not done already
VL


Leyla Ramin lram5228=-=usyd.edu.au a écrit :
> Sent to CCL by: "Leyla  Ramin" [lram5228%a%usyd.edu.au]
> Hi,
>
> I am wondering if anybody has the available fortran code for MD of Lennard jones molecules including Link cell method and Neighbour list together? I already tried to use the code in CCL website but when I tried to put the neighbour list and link cell together, The result that I get is not so accurate. 
>
> Best Regards
> Leila
>
>