From owner-chemistry@ccl.net Mon Aug 22 09:09:33 2005
From: "CCL" <owner-chemistry(a)server.ccl.net>
To: CCL
Subject: CCL: ORCA DOWNLOAD - BUGFIX
Message-Id: <-28982-050822090737-31958-jTKKlThOvCLwkE03HCXsVw(a)server.ccl.net>
X-Original-From: Frank Neese <neese(a)mpi-muelheim.mpg.de>
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Sent to CCL by: Frank Neese <neese(a)mpi-muelheim.mpg.de>
Dear CCL'ers,

last week we have announced the public availability of the ORCA electronic 
structure package  which is free of charge for academic users. 
Unfortunately there has been an error in our internet-download page. This 
error has been fixed now and the download should proceed without problems.

please enjoy the program!
best regards,

Frank


From owner-chemistry@ccl.net Mon Aug 22 10:21:10 2005
From: "CCL" <owner-chemistry]_[server.ccl.net>
To: CCL
Subject: CCL: Correcting Bond Order using Autodock
Message-Id: <-28983-050819122745-22009-oZyCmmi1Zi6Saa9t56UyEA]_[server.ccl.net>
X-Original-From: Laura Beckford <laura.beckford]_[mycampus.uoit.ca>
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Sent to CCL by: Laura Beckford <laura.beckford]_[mycampus.uoit.ca>
Does anyone know how to correct the bond order of a pdb file?

Thanks

Laura Beckford
laura.beckford]_[mycampus.uoit.ca


From owner-chemistry@ccl.net Mon Aug 22 16:51:37 2005
From: "CCL" <owner-chemistry-#-server.ccl.net>
To: CCL
Subject: CCL: W:Subscribe
Message-Id: <-28984-050822164929-4760-oZyCmmi1Zi6Saa9t56UyEA-#-server.ccl.net>
X-Original-From: "Zengjian  Hu" <huzengjian-#-yahoo.com>


Sent to CCL by: "Zengjian  Hu" <huzengjian-#-yahoo.com>
Zengjian Hu
huzengjian-#-yahoo.com


From owner-chemistry@ccl.net Mon Aug 22 21:52:54 2005
From: "CCL" <owner-chemistry]|[server.ccl.net>
To: CCL
Subject: CCL: modling nanocrystals
Message-Id: <-28985-050821034510-20063-3Q2toAJl3arLutGIoplTQw]|[server.ccl.net>
X-Original-From: may abdelghani <may01dz]|[yahoo.fr>
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Sent to CCL by: may abdelghani <may01dz]|[yahoo.fr>
Hello, CCLers
If you want to study, theoreticaly, the properties of
a nanocrystals,you treat it like a crystal (using
solid stats theory), molecule or like what?
What it the best models that can described this new
kind of mater?

Thanks very much for your time. 
may abdelghani 



	

	
		
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