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[News]
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Can we trust docking results?
Sept 2010 IBM Systems and Technology Group releases a white paper with eHiTS and Cell
Oct 2008
EPA's ToxCastTM project will use SimBioSys' eHiTS as docking engine
Nov, 2007
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[Events]
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| 243rd ACS
Mar 25-29, 2012
San Diego, CA
see >> more
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booth #619
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Using Computer
Assisted Organic Synthesis Design in Teaching
Date & Time: Mon., Aug 20, 2007
11:00 - 11:30 am
Location: booth# 619
Repeated: Mon., Aug 20, 2007 12:00 - 12:30 pm
Abstract:
ARChem
is an automated tool for designing synthetic pathways to molecules. The
program automatically extracts chemical rules from literature reaction
databases and uses those rules to perform a retrosynthetic analysis of
a target organic molecule. The program offers a wealth of synthetic
route alternatives, each with direct links to literature reactions,
making it a great idea generator when designing synthetic pathways.
This demonstration will show how software tools, like ARChem, can be
used in teaching to spark ideas and generate debate on the appropriate
use of suggested route and reactions. Using modern computational tools
in the classroom can revolutionize the teaching of synthetic organic
chemistry. The demonstration will be repeated at 12 noon, Monday Aug.
20th, 2007.
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Back to the SimBioSys ACS 2007 Event Page
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