From chemistry-request@ccl.net Wed Aug 7 11:40:56 1991 Date: Wed, 7 Aug 1991 09:21 EDT From: "DOUGLAS A. SMITH" Subject: MOPAC 6.0 for Stardent 3000 To: chemistry@ccl.net Status: R We have finished an optimized but unvectorized port of MOPAC 6.0 on the Stardent 3000. We plan to do vectorization sometime between now and the end of the year. If anyone is interested in this code, please contact either myself or Joe Leonard of Stardent. Doug Smith Assistant Professor of Chemistry The University of Toledo Toledo, OH 43606-3390 voice 419-537-2116 fax 419-537-4033 email fax0236@uoft02.utoledo.edu Joe Leonard Stardent Computer Inc 6 New England Tech. Center Concord, MA 01742 voice 508-287-0100 fax 508-371-7414 email jle@stardent.com P.S. The Stardent (we have a 3040 at Toledo with G3 and P3 boards, running the latest operating system, 4.0) really moves. We have processed up to 26 MOPAC 6.0 jobs in one evening - jobs that take between 1 and 3 hours each on our DECstation 3100's. From chemistry-request@ccl.net Wed Aug 7 12:05:46 1991 Date: Wed, 7 Aug 1991 17:33 +0100 From: Pieter Stouten Subject: GROMOS mailing list (forwarded announcement). To: rmb@igc.ethz.ch, chemistry@ccl.net, stouten@EMBL-Heidelberg.DE Status: R Please find below the announcement of the GROMOS mailing list. I forward this message on behalf of the list coordinator Roger Brunne . --------------------------------------------------------------------------- GROMOS is a molecular dynamics package developed by Prof. W. F. van Gunsteren, Zurich, and Prof. H. J. C. Berendsen, Groningen. For the benefit of users (and anyone else interested), a mailing list has been set up. Everybody interested in participating in the GROMOS-mailing list for ***SCIENTIFIC*** purposes only, is welcome to put their name on the list by sending a request of the kind please subscribe jsmith@power.place.edu to the following address gromos-request@igc.ethz.ch All ADMINISTRATIVE messages MUST go to gromos-request@igc.ethz.ch !!!!!!!! If you send them to the list, everybody will be harassed by your administrivia. Send all messages of general interest to any GROMOS user to the address of the GROMOS-mailing list: gromos@igc.ethz.ch Currently in charge of maintenance of this list: Roger M. Brunne Laboratorium f. Physikalische Chemie ETH Zentrum CH-8092 Zurich Switzerland Tel.: +41-1-256 5504 E-mail: gromos-request@igc.ethz.ch From chemistry-request@ccl.net Wed Aug 7 12:17:14 1991 Date: Wed, 7 Aug 91 08:45 CDT From: KIM%cmda.abbott.com@RELAY.CS.NET Subject: QSAR Society To: chemistry%ccl.net@RELAY.CS.NET Status: R Dear Dora M. Schnur: You can contact the following person to join the International QSAR Society. Prof. John H. Block College of Pharmacy Oregon State University Corvallis, OR 97331 If you have any problem, you can contact me again. Ki H. Kim Abbott Laboratories CAMD, D47E, AP9A Abbott Park, IL 60064 (708)937-5797 E-mail: KIM@CMDA.ABBOTT.COM From chemistry-request@ccl.net Wed Aug 7 17:28:11 1991 Date: Wed, 7 Aug 91 13:57:34 -0700 From: Hitomi Ohkawa To: chemistry@ccl.net Subject: Wanted: Information on BioCAD System Status: R Hello, I am interested in getting information on Computer-Aided Chemistry systems produced by BioCAD Corporation. Supported hardware platforms, usability, performance, graphical facilities, databases, etc. any information is appreciated. Thank you very much in advance. ------------------------------------------------------------ Hitomi Ohkawa hitomi@cse.ogi.edu(CSNET) Department of Computer Science and Engineering Oregon Graduate Institute of Science and Technology 19600 N.W. Von Neumann Drive Beaverton, OR. 97006-1999 U.S.A. (503)690-1121 ------------------------------------------------------------