From owner-chemistry@ccl.net Sat Mar 30 14:19:49 1996 Received: from bedrock.ccl.net for owner-chemistry@ccl.net by www.ccl.net (8.7.1/950822.1) id NAA23762; Sat, 30 Mar 1996 13:29:19 -0500 (EST) Received: from cbdcom.apgea.army.mil for grfamini@cbdcom.apgea.army.mil by bedrock.ccl.net (8.7.1/950822.1) id NAA13521; Sat, 30 Mar 1996 13:29:16 -0500 (EST) Date: Sat, 30 Mar 96 13:20:41 EST From: George R Famini To: chemistry@ccl.net Subject: [George R Famini: Tentative Program for Orlando] Organization: International Programs Office Priority: Normal Message-ID: <9603301320.aa05685@cbdcom.apgea.army.mil> The Division of Computers in Chemistry of the American Chemical Society met Sunday August 24th to develop the tentative agenda for the symposia to be offered at the Orlando ACS meeting (25-29 August). The tentative schedule is: Symposium Sun Mon Tues Wed Thurs Human Genome D D De Novo Drug Design P D Elucidation of Org Mech D D D by Ab Initio Methods Molecular Dynamics D A and FEP Verification and D Validaion of Mol Mod Algorithms Computational P D D Thermochemistry Comp Adv in D D D Inorg Chem Global Energy Min D A D and Protein Folding Internal Industrial and P Academic Appl of the Internet General Poster E General Oral D SciMix E D = All Day, P= Afternoon Session, A= Morning Session, E= Evening Session Please note this schedule is tentative, and may still change depending on the number of abstracts received. As you can see, our Orlando will be very full. Therefore, it is not likely I will be able to open additional sessions unless some other sessions are cancelled. It is vital, then, if you are planning to submit an abstract to one of the symposia other than the General Oral or General Poster, to contact the appropriate symposium organizer and assure there are still openings for presentations. We will always accept posters (effectively unlimited space) and General Oral presentations are not usually a problem. Abstracts are due to you by 19 April. There was some difficulty with this last October. If you do not get your abstract in by the due date, I reserve the right to reject any abstracts after that date (haven't done that yet, but because of my own tight schedule, I may have to this time around. So, please try to be kind to you Program Chair and get your abstract in early. In fact, I'll accept any General Oral or General Poster now, it'll make my life that much easier.) George Famini COMP Program Chair American Chemical Society Computers in Chemistry Division Orlando Meeting, August 25-29, 1996 Program Chair: George R. Famini, U.S. Army Edgewood Research, Development and Engineering Center, SCBRD-ASI, Aberdeen Proving Ground, MD 21010; Voice: (410)671-2552; Fax: (410)671-5373; email: grfamini@apgea.army.mil. Four (4) copies of 150-word abstract (Original on ACS Abstract Form) are due by April 19, 1996 to respective session or symposium chairpersons. The Human Genome - Dr. Michael N. Liebman, Vysis, Inc, 3100 Woodcreek Dr, Downers Grove, IL, 60515; voice: (708)271-7190; fax: (708)271-7008; email: mliebman@amoco.com. De Novo Drug Design - Dr. Mark A. Murcko, Vertex Pharmaceuticals Inc., 40 Alston St., Cambridge, MA 02139; voice: 617-576-3111; fax: 617-576-2109; email: markm@portal.vpharm.com. Elucidation of Organic Mechanisms by Ab Initio Methods - Dr. Jeffrey Evanseck, University of Miami, Department of Chemistry, 1301 Memorial Drive, Coral Gables, FL 33124; voice: (305)284-2194; fax: (305)284- 2174; email: jevansec@umiami.ir.miami.edu. Molecular Dynamics and Free Energy Pertubation Methods - Dr. Alexander Tropsha, Director, Laboratory for Molecular Modeling, CB #7360, Beard Hall, School of Pharmacy, University of North Carolina, Chapel Hill, NC 27599; voice: (919)966-2955; fax: (919)966-6919; email: tropsha@gibbs. oit.unc.edu . Verification and Validation of Molecular Modeling Algorithms -Dr. Adi M. Treasurywala, Allelix Biopharmaceuticals Inc., 6850 Goreway Drive, Mississauga Ont L4V 1V7 CANADA ; voice: (908)677 0831 (x238); Fax: (908)677 5344 or (908)6779595; email: adit@extreme.rpi.edu Computational Thermochemistry - Dr. Karl Irikura, National Institute of Standards and Technology; voice: (301)975-2510; fax (301)926-4513; email: irikura@enh.nist.gov Computational Advances in Inorganic Chemistry - Dr. Michael B. Hall, Department of Chemistry, Texas A&M University, College Station, TX 77843; voice: (409)845-1843; fax: (409)845-4719; email: HALL@chemvx.tamu.edu. Global Energy Minimization and Protein Folding - Dr. Ruth Pachter, WL/MLPJ, Building 651, WPAFB, OH 45433-7702; voice: (513) 255-6671 ext 158; email:PACHTERR@ml.wpafb.af.mil. Internal Industrial and Academic Applicaitons of the Internet- Dr. Thomas Pierce, Rohm and Haas Co. P.O. Box 219 Bristol, PA 19007; Voice: (215) 785-8989; FAX (215) 781-4204; email: thpierce@rohmhaas.com, Steven Bachrach, Department of Chemistry, Northern Illinois University, DeKalb, Il 60115;voice: (815)753-6863; Fax: (815)753-4802; email: smb@smb.chem.niu.edu, Dr Henry Rzepa, Dept. Chemistry, Imperial College, LONDON SW7 2AY; voice: (44) 171 594 5774 or 594 5809. Fax: (44) 171 594 5804; email: rzepa@ic.ac.uk via Eudora 2.03, World-Wide-Web URL: http://www.ch.ic.ac.uk/rzepa.html. General Computational Chemistry - Poster and/or Oral Sessions - Dr. George R. Famini, US Army Edgewood Research, Development and Engineering Center, SCBRD-ASI, APG, MD 21010; voice: (410)671- 2552; Fax: (410)671-5373; email: grfamini@apgea.army.mil. ----- End of forwarded messages From owner-chemistry@ccl.net Sat Mar 30 22:19:47 1996 Received: from bedrock.ccl.net for owner-chemistry@ccl.net by www.ccl.net (8.7.1/950822.1) id VAA26070; Sat, 30 Mar 1996 21:27:38 -0500 (EST) Received: from beowulf.cox.miami.edu for evanseck@beowulf.cox.miami.edu by bedrock.ccl.net (8.7.1/950822.1) id VAA16928; Sat, 30 Mar 1996 21:27:37 -0500 (EST) Received: by beowulf.cox.miami.edu (AIX 3.2/UCB 5.64/4.03) id AA12175; Sat, 30 Mar 1996 21:27:54 -0500 Date: Sat, 30 Mar 1996 21:27:54 -0500 (EST) From: "Jeffrey D. Evanseck" Subject: ORLANDO ACS Call for papers. To: chemistry@ccl.net Message-Id: Mime-Version: 1.0 Content-Type: TEXT/PLAIN; charset=US-ASCII A CCCCC SSSSS A A C C S S A A C S A A C SSSSS AAAAAAA C S A A C C S S A A CCCCC SSSSS --------------- CALL FOR PAPERS --------------- "Elucidation of Organic Reaction Mechanism by Ab Initio Methods" National Meeting Orlando, Florida August 25-29th, 1996 Sponsored by the Division of Computers in Chemistry Organized by J. D. Evanseck University of Miami Partial List of Speakers Thomas Albright University of Houston Michael Bartberger University of Florida Bernie Brooks National Institute of Health David Chatfield Florida International Univ. Christopher Cramer University of Minnesota Jiali Gao SUNY, Buffalo Rainer Glaser University of Missouri Mark Gordon Iowa State University Robert Haddon Bell Laboratories Warren Hehre Wavefunction, Inc. Ken Houk UCLA Frank Jensen Odense University, Denmark William Jorgensen Yale University Angel Kaifer University of Miami Jasna Klicic Columbia University Alex MacKerell University of Maryland, Baltimore Keiji Morokuma Emory University Ramkumar Rajamani University of Miami Henry Schaefer III University of Georgia Jimmy Stewart Stewart Computational Chemistry, Inc. Bert Thomas III Procept, Inc. Walter Thiel Zurich, Switerland Donald Truhlar University of Minnesota Thanh Truong University of Utah Ken Wiberg Yale University Olaf Wiest University of Notre Dame Hendrik Zipse Berlin University, Germany Four (4) copies of 150-word abstract (original on ACS form) are due by April 19th, 1996. Please send all abstracts or correspondance to: J. D. Evanseck University of Miami Chemistry Department 1301 Memorial Drive Coral Gables, FL 33124-0431 FAX: (305) 284-1880 Voice: (305) 284-2194 (2174) E-mail: jevansec@umiami.ir.miami.edu Sincerely, Jeffrey D. Evanseck ******************************** Jeffrey D. Evanseck Assistant Professor of Chemistry University of Miami Department of Chemistry 1301 Memorial Drive Coral Gables, Florida 33124-0431 e-mail: evanseck@beowulf.cox.miami.edu v-mail: (305) 284-2194 FAX: (305) 284-4571