Re: QSAR - ACS session announcement: Washington DC 2005

From: Curt Breneman <brenec#%#rpi.edu>
Date: Thu, 03 Mar 2005 11:16:19 -0500

Dear Andrew,

This sounds like an interesting symposium on a pertinent topic - I'm
certain that our research group will wish to be represented there.

Cheers,

Curt Breneman
RPI Chemistry
COMP Treasurer

Smellie, Andrew wrote:

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>>Dear Colleagues
>>
>>We wanted to draw your attention to a symposium that we are organizing at
>>the Fall ACS meeting in Washington D.C. on the visualization and interpretation
>>of molecular models. We thought that you might wish to contribute a talk to the
>>session, or know of someone who would like to participate. If you are interested, the
>>details are in the call for papers below.
>>
>>We would be grateful if you would give it your consideration, or pass it on to someone
>>who might be interested
>>
>>Regards
>>
>>Dr. Andrew Smellie, Dr. Anton Filikov and Dr. Rocio Palma
>>Arqule Inc.
>>19 Presidential Way, Woburn MA 01801
>>USA
>>asmellie%a%arqule.com
>>781-994-0559 (direct)
>>781-994-0679 (fax)
>>
>>
>>
>>230th ACS National Meeting,
>>Washington DC,August 28 - September 1, 2005
>>COMP division
>>
>>2nd Call for papers
>>
>>The Visualization and Interpretation of Computational Models
>>============================================================
>>
>>There are many different approaches available for modeling
>>chemical data. Biological activities can be estimated using a
>>number of approaches such as numerical modeling, pharmacophore
>>construction or structural comparisons. The interaction of small
>>molecules to binding sites can be described using docking models,
>>shape comparisons or pharmacophores. Physico-chemical
>>properties can be estimated using a variety of techniques.
>>
>>All these problems share one common and often unresolved
>>issue. Whatever the model is teaching us about the system in
>>question must be communicated to the clients of the model.
>>This symposium will focus on methods that have been developed to aid
>>in the interpretation of models of all types common in
>>Computational Chemistry. The symposium will not discuss new
>>modeling techniques, but will focus on methods that have been devised
>>to extract the maximum information from the models and communicate
>>that information to clients.
>>
>>Papers are invited that cover issues on
>>* Visualization of Modeling Data
>>* Interpretation of Modeling Data
>>* Communication of knowledge from the model to clients
>> (e.g. chemists, biologists etc)
>>
>>The organizers are Andrew Smellie, Anton Filikov and
>>Rocio Palma of Arqule Inc.
>>
>>Please submit your abstracts to via the ACS OASYS system
>>at http://oasys.acs.org/acs/230nm/oasys.htm
>>
>>Further information about the symposium can be found at
>>http://www.arqule.com/wt/arc/ACS230
>>
>>We look forward to your contribution is this vital area
>>of research and development.
>>
>>Dr. Andrew Smellie
>>Senior Scientist
>>Arqule Inc.
>>19 Presidential Way, Woburn MA 01801
>>USA
>>asmellie[*]arqule.com
>>781-994-0559 (direct)
>>781-994-0679 (fax)
>>
>>
>>
>>
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Received on 2005-03-03 - 13:17 GMT

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