From chemistry-request %-% at %-% www.ccl.net Wed Jan 27 17:04:03 1999 Received: from oc30.uni-paderborn.de (oc30.uni-paderborn.de [131.234.240.90]) by www.ccl.net (8.8.3/8.8.6/OSC/CCL 1.0) with ESMTP id RAA14829 Wed, 27 Jan 1999 17:04:00 -0500 (EST) Received: from localhost (cpilger -8 at 8- localhost) by oc30.uni-paderborn.de (980427.SGI.8.8.8/980728.SGI.AUTOCF) via ESMTP id XAA35973; Wed, 27 Jan 1999 23:02:38 +0100 ("MET) Date: Wed, 27 Jan 1999 23:02:37 +0100 From: Christian Pilger To: Jan De Kerpel cc: chemistry $#at#$ www.ccl.net Subject: Re: CCL:academic docking software In-Reply-To: Message-ID: MIME-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII Hi Jan, > I am looking for receptor/ligand protein docking software > (flexible and/or rigid) like FlexiDock or Affinity (provided > by some commercial groups) but for low/free prices (academic > usage). > To be run on sgi R10000, IBM RS6000 or pc. > > Thanks, > Jan De Kerpel > email : jan.dekerpel #at# chem.kuleuven.ac.be you should take a look at the following URL: http://www.scripps.edu/pub/olson-web/doc/autodock/ I got good results (compared to X-ray) employing autodock. I used the software on SGI, SUN, and LINUX. Regards, Christian ----------------------------------------------------------------- Dipl.-Chem. Christian Pilger Uni-GH Paderborn FB 13 - Organische Chemie Warburger Str. 100 D-33098 Paderborn Tel.: 05251-60279/-602183 Fax : 05251-603245 email: cpilger%!at!%oc30.uni-paderborn.de ----------------------------------------------------------------- > > ************************************************************* > > Labo Quantumchemistry Celestijnenlaan 200F > Departement of Chemistry 3001 Leuven (Heverlee) > Katholieke Universiteit Leuven BELGIUM > > tel : 32 16 327393 > fax : 32 16 327992 > > email : jan.dekerpel -A_T- chem.kuleuven.ac.be > > ************************************************************* > > > > --- > Administrivia: This message is automatically appended by the mail exploder: > CHEMISTRY $#at#$ www.ccl.net: Everybody | CHEMISTRY-REQUEST $#at#$ www.ccl.net: Coordinator > MAILSERV ^at^ www.ccl.net: HELP CHEMISTRY or HELP SEARCH | Gopher: www.ccl.net 73 > Anon. ftp: www.ccl.net | CHEMISTRY-SEARCH[ AT ]www.ccl.net -- archive search > Web: http://www.ccl.net/chemistry.html > --- >