From chemistry-request- at -ccl.net Tue Dec 30 07:02:15 2003 Received: from elrond.chem.uni.wroc.pl (elrond.chem.uni.wroc.pl [156.17.103.206]) by server.ccl.net (8.12.8/8.12.8) with ESMTP id hBUC1hTC024501 for ; Tue, 30 Dec 2003 07:01:43 -0500 Received: from jarek (helo=localhost) by elrond.chem.uni.wroc.pl with local-esmtp (Exim 3.35 #1 (Debian)) id 1AbIZB-0001ev-00 for ; Tue, 30 Dec 2003 13:01:41 +0100 Date: Tue, 30 Dec 2003 13:01:41 +0100 (CET) From: Jaroslaw Panek To: chemistry_at_ccl.net Subject: CCL: when to take a logarithm of biological activity in QSAR studies? Message-ID: MIME-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII X-Spam-Status: No, hits=0.0 required=7.0 tests=USER_AGENT_PINE version=2.55 X-Spam-Checker-Version: SpamAssassin 2.55 (1.174.2.19-2003-05-19-exp) Dear CCLers, there is an established tradition of taking a LOGARITHM of concentrations (e.g. -log (IC50), -log(ED50) ) as biological activity parameter in QSAR studies. As I understand, this comes either from the need to bring widely different numerical data (like 0.0001 and 0.1) into more balanced scale, or from generally logarithmic nature of biological response to external stimuli. Now, my question is: do you think that when applying other, non-concetration-based types of biological activity, one should also take their logarithm for QSAR studies? I am thinking specifically about percentages, as in "inhibition percentage", which are commonly encountered as results of biological assays. Happy New Year to everybody! Jaroslaw Panek Faculty of Chemistry, University of Wroclaw ul. F. Joliot-Curie 14, 50-383 Wroclaw, Poland