From chemistry-request@server.ccl.net Tue Apr 16 09:24:08 2002 Received: from aspirine.u-strasbg.fr (IDENT:root@[130.79.84.250]) by server.ccl.net (8.11.6/8.11.0) with ESMTP id g3GDO7j25292 for ; Tue, 16 Apr 2002 09:24:07 -0400 Received: from hit8.pharma.u-strasbg.fr (lead2.u-strasbg.fr [130.79.85.21]) by aspirine.u-strasbg.fr (8.10.2/8.10.2) with ESMTP id g3GDLDg18207; Tue, 16 Apr 2002 15:21:13 +0200 Message-Id: <5.1.0.14.0.20020416152026.01733bd8@aspirine.u-strasbg.fr> X-Sender: rognan@aspirine.u-strasbg.fr X-Mailer: QUALCOMM Windows Eudora Version 5.1 Date: Tue, 16 Apr 2002 15:24:00 +0200 To: quch0@yahoo.com From: Didier Rognan Subject: docked datasets Cc: chemistry@ccl.net Mime-Version: 1.0 Content-Type: text/plain; charset="us-ascii"; format=flowed Please find here a dataset of 100 protein-ligand complexes for which we have computed the top 30 docked solutions using Dock, FlexX and Gold. The dataset can be downloaded at the following URL: http://med-chem.u-strasbg.fr/~didier/db/dock_base.html Regards ----------------------------------------------------------------------------------------------- Dr. Didier ROGNAN Directeur de Recherches - CNRS Laboratoire de Pharmacochimie de la Communication Cellulaire UMR 7081 74, route du Rhin, B.P.24 F-67401 Illkirch phone: +33 (0)3 90 24 42 35 fax: +33 (0)3 90 24 43 10 mobile: +33 (0)6 89 56 24 46 email: didier.rognan@pharma.u-strasbg.fr