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From: Michael Tor Klawansky <mk34+@andrew.cmu.edu>
To: Outbound News
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Subject: CCL:METHODS OF MOLECULAR MECHANICS WORKSHOP
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*****
NOTE:When replying please reply to ropelews@slave.psc.edu
*****

"METHODS OF MOLECULAR MECHANICS AND DYNAMICS OF BIOPOLYMERS" WORKSHOP
                    Pittsburgh Supercomputing Center           
                           August 16-19, 1995


The Pittsburgh Supercomputing Center (PSC) is hosting a workshop 
on "Methods of Molecular Mechanics and Dynamics of Biopolymers," 
August 16-19, 1995.  
The workshop will familiarize biomedical researchers with 
computational methods and provide practice
in applying supercomputing resources to problems of concern in molecular 
mechanics.  Practical experience on our supercomputers will be gained in  
the application to: 
(1) the theory and practice of molecular mechanics and dynamics;  
(2) the development and refinement of molecular mechanics force fields; 
(3) the problem of conformation mapping and analysis of polypeptide 
structures, including the refinement of structure from measured NMR data; 
and 
(4) computation of interaction energies and free energies for protein-drug
interactions and conformational thermodynamics.  

Workshop leaders are
Dr. Charles L. Brooks III, The Scripps Research Institute 
and 
Dr. Alexander D. MacKerell Jr., University of Maryland at Baltimore.

The worskhop will consist of lectures and extensive hands-on sessions.
General aspects of molecular mechanics software will be discussed and
a number of packages are available for use at the PSC.  However, 
the programs CHARMM and QUANTA will be utilized most extensively in 
demonstrations.  Hands-on sessions will be emphasized. 
Participants will be able to work on the examples provided or 
on their own experimental data. 
No prior supercomputing experience is necessary.  

This workshop is funded by a grant from the Biomedical Research Technology
Program, National Center for Research Resources, National Institutes of 
Health.  TRAVEL, MEALS AND HOTEL ACCOMMODATIONS FOR RESEARCHERS AFFILIATED
WITH U.S. ACADEMIC INSTITUTIONS ARE SUPPORTED BY THIS GRANT.
Enrollment is limited to 20.  An application form is included.  
Deadline for applications is: June 22, 1995.
Please direct inquires or send the following application form to 
blankens@psc.edu.


Additional information about this workshop can be found in 
http://pscinfo.psc.edu/biomed/workshops95.html



                         PITTSBURGH SUPERCOMPUTING CENTER
                         BIOMEDICAL  INITIATIVE
                         **************************************
                         August 16-19, 1995

                         APPLICATION  


Name:________________________________________________________________________ 
 
Affiliation:_________________________________________________________________

Address:_____________________________________________________________________
                                  (Business) 
_____________________________________________________________________________
                  
____________________________________________________________________________
                                    (Home)                  
____________________________________________________________________________ 
 
Telephone:  ____________________              ______________________ 
                (Business)                            (Home) 
 
*Social Security Number:  _______-_____-_______    Citizenship: ____________

Electronic Mail Address:____________________________________________________ 

Status: ___Graduate  ___Post-doctoral Fellow  ___Faculty  ___Other (specify) 
 
Please indicate specifically any special housing, transportation or dietary 
arrangements you will need:  _______________________________________________
 
How did you learn about this workshop? _____________________________________

    
REQUIREMENTS: 

Applicants must submit a completed application form and a cover letter. The 
letter should describe, in one or two paragraphs, your current research and  
how participating in the workshop will enhance this research.  Please 
include a brief statement describing your level of experience with computers. 
Faculty members, staff and post-docs should provide a curriculum vita. 
Graduate students must have a letter of recommendation from a faculty member.  
 
Please return all application materials by June 22, 1995 to:

          Biomedical Workshop Applications Committee 
          Pittsburgh Supercomputing Center 
          4400 Fifth Avenue, Suite 230C 
          Pittsburgh, PA 15213 
 
Direct inquiries to: Nancy Blankenstein, blankens@psc.edu or 412/268-4960.

*Disclosure of Social Security Number is voluntary.

PSC does not discriminate on the basis of race, color, religion, sex, age, 
creed, national or ethnic origin, or handicap. 
 





From BIOSCI-REQUEST  Fri Jun 16 14:14:14 1995
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From: "Zeiler, Brian            M'bio" <BrianZ@microbio.lifesci.ucla.edu>
To: methods-and-reagents <methods-and-reagents@net.bio.net>,
        RNA <RNA@net.bio.net>
Subject: 3-D RNA modeling
Date: Fri, 16 Jun 95 14:13:00 PDT
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Hello fellow netters,

I am conducting some experiments relating to RNA structure.  I work with 
small RNAs, usually less than 100 nucleotides.  I have access to a good 
folding program, mulfold, through the GCG package and have extensively 
folded my molecules and got nice two dimensional representations.  However, 
it is becoming clear that I should be concerned with the three dimensional 
structure of my molecules.  Does anyone know if three dimensional modelling 
programs exist?  Any help and insights will be welcome.

Brian Zeiler
brianz@microbio.lifesci.ucla.edu

From BIOSCI-REQUEST  Mon Jun 26 06:59:55 1995
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Date: Mon, 26 Jun 1995 09:54:48 -0400 (EDT)
Subject: Ribosomal Operons
To: rna@net.bio.net
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I am interested in the use of ribosomal sequences for constructing probes and
primers used in molecular diagnostics and subtyping in food microbiology.
This work has raised several questions regarding the occurance of
multiple ribosomal operons in microbial genomes, and I am hoping that the 
members of this list can point me to the answers.

First, is there a list of the number of ribosomal operons that occur in
different microbial genomes for a range of species.  I have seen papers that
refer to the number for several individual species (E. coli, B. subtilis,
etc.), but not a general listing, or general review for that matter.

Second, what is known about sequence conservation between the different operons
that occur in a single genome?  Do the ribosomal coding sequences differ?  How
much variability is there in the spacer regions?  Are the answers to these
questions consistent in different species?

Third, while I think of it, what is the easiest way to count how may operons
there are in the genome of a species or strain?

Fourth, is anything known about the relative transcription rates for different
operons in the same genome?  


Thanks for your help.

Steven Gendel
Chief, Biotechnology Studies Branch
FDA, Center for Food Safety and Applied Nutrition
6502 S. Archer 
Summit, Illinois  60501
708-728-4110
smg@vax8.cfsan.fda.gov


