update on Symp. on Mol. Design

From: "DONALD B. BOYD" <QSAR%INDYLLY.BITNET "at@at" OHSTVMA.ACS.OHIO-STATE.EDU>
Subject: update on Symp. on Mol. Design
Date: Wed, 24 Apr 91 08:53 EST
The "SYMPOSIUM ON MOLECULAR DESIGN AND MODELING" is being held at
 the
 Joint Central-Great Lakes Regional American Chemical Society Meeting,
 Wednesday, May 29 - Friday, May 31, 1991, Conference Center, Indiana
 University-Purdue University at Indianapolis (IUPUI), Indianapolis,
 Indiana.
 The following additions to the program have been made since the bitnet
 announcement was sent out a month ago.
 Additional invited speaker:
 __ Russell J. Bacquet, Electrostatic Contributions to Binding Affinity
 for the Enzyme Thymidylate Synthase and a Series of Inhibitors.
 (Agouron Pharmaceutical).
 Additional posters (for poster session Friday morning, May 31):
 __  Erik C. Chelius* and Wayne D. Luke ,  Syn/Anti Regiocontrol in
 Aldimines - An Ab Initio Study.  (Eli Lilly & Company).
 __  David K. Clawson, Richard W. Schevitz , Jean-Pierre Wery, Jesse L.
 Bobbitt, Ernest R. Dow, Gary Gamboa, Theodore Goodson, Jr.,  Robert B.
 Hermann*, Ruth M. Kramer, Don B. McClure, Edward D. Mihelich, James E.
 Putnam, John D. Sharp, Daniel H. Stark, Carroll E. Teeter, Michael W.
 Warrick, and Noel D. Jones,  The Structure of Recombinant Human
 Rheumatoid Arthritic Synovial Fluid Phospholipase A2 at 2.2  Resolution.
 (Eli Lilly & Company).
 __ Keith Davies, Deborah Dunn*, and Roger Upton, An Algorithm to
 generate 3D Structures from 2D Connection Tables.  (Chemical Design).
 __ Ruth Pachter*, Timothy J. Bunning, and W. Wade Adams, Molecular
 Modeling and X-Ray Scattering from Cyclic Siloxane-Based Liquid
 Crystals. (Wright-Patterson).
 __ Ruth Pachter*, Russ B. Altman, Cheryl H. Arrowsmith, Jerzy Czaplicki,
 and Oleg Jardetsky,Validation and Application of the Double Iterated
 Kalman Filter Technique to Structure Determination of Proteins from NMR
 Data. (Wright-Patterson).
 __ Shi-Yi Yue*, Z. Szewczuk, J. DiMaio, E. O. Purisima, F. Ni and Y.
 Konishi, Characterization of the Interactions of a Bifunctional
 Inhibitor with alpha-Thrombin by Molecular Modelling and Peptide
 Synthesis. (Biotechnology Research Institute, Montreal).
 __ Adrian E. Roitberg* and Ron Elber, Enhanced Sampling of Side Chain
 Conformations in Peptides and Proteins: A Combined LES/Simulated
 Annealing Method.  (University of Illinois at Chicago).
 __ Philip Kym*, Rajgopal Srinivasan, John A. Katzenellenbogen, and
 Michael J. Sofia, Monte Carlo and Molecular Dynamics on Substance P
 Antagonists. (University of Illinois at Urbana-Champaign).
 __ Connor McGrath*, Rick Gussio, Louis Henderson, and Larry Arthur, An
 HIV-1 gag p7-RNA Complex Model through Molecular Dynamics.  (National
 Cancer Institute).
 __ Rick Gussio*, Connor McGrath, and Jih-Hsiang Chen, Electrostatic
 Evaluation of 4,5-alpha-Epoxymorphinan Pseudoreceptor Complexes.
 (National Cancer Institute).
 _  Michael B. Bass* and Rick L. Ornstein, Mutations Designed to Affect
 the Product Specificity of Cytochrome P-450cam as Studied by Molecular
 Dynamics Simulations.  (Battelle Pacific Northwest).
 __ Leonore A. Findsen*, Apryle L. Griffith, and Kari J. Seger, Analysis
 of Conformations of Pentacyclic Pirenzepine Derivatives.  (University of
 Toledo, College of Pharmacy).
 (The paper by D. Eric Walters, J. Chris Culberson, Darold L. Madigan, and
 George W. Muller on "Application of Molecular Modeling to the Design of
 New High-Potency Sweeteners" is withdrawn.)
 In addition to the "SYMPOSIUM ON MOLECULAR DESIGN AND MODELING", the
 Joint Central-Great Lakes Regional ACS Meeting will have a number of
 other symposia of interest to the computational community.  The full
 program is in the April 1 issue of "Chemical and Engineering News".  A
 partial list of these participants includes:
 Joseph Augspurger, Rodney Bartlett, David Bishop, Steven Bryn, Carl
 David, Ernest Davidson, Roger DeKock, Guy Dodson, Michael Dupuis,
 Clifford Dykstra, Irving Epstein, James Harrison, Barry Honig, John
 Katzenellenbogen, Bernard Kirtman, Raima Larter, David Malik, Daniel
 Pasto, Russell Pitzer, Julius Rebek, Steve Scheiner, Klaus Schulten,
 Larry Steinrauf, Donald Williams, and Peter Wolynes.
 Registration and housing information can be obtained from Dr. Lee
 Bobbitt, telephone (317) 276-4656, bitnet rx15481 "at@at" indylly.
 From: BOYD DONALD B                 (MCVAX0::QSAR)
 To:   VMS MAIL ADDRESSEE            (BITNET::"chemistry "at@at"
 ccl.net")
 cc:   BOYD DONALD B                 (MCVAX0::QSAR)