From chemistry-request ^at^ www.ccl.net  Mon Sep 14 05:15:30 1998
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Date: Mon, 14 Sep 1998 13:14:35 +0400 (MSD)
From: "Serge A. Pisarev" <serge;at;qsar.chem.msu.su>
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To: chemistry:~at~:www.ccl.net
Subject: PBE for conformations
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Dear CCLers
	Has anyone the experience in applying the Perdew group density
	functionals (PBE in particular) to the conformational analysis
	of organic molecules and their characteristics related to 
	other functionals (BLYP, B3LYP, WVN etc)
	Thank you in advance. I'll summarize the answers, if any.
	Serge

Serge A. Pisarev, QSAR and Computational Organic Chemistry Group,
Chemistry Department, Moscow State University.
Email:	serge:~at~:org.chem.msu.su
WWW:	http://org.chem.msu.su/~serge