Webinar: How to create Bioactivity Predictive Model with Reaxys and Reaxys Medicinal Chemistry

May 17, 2016 10:00 AM EDT
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Did you know that Reaxys Medicinal Chemistry has millions of bioactivity measurements for thousands of targets? These measurements are associated protein targets and chemical structures. Solutions Consultant Dr. Matt Clark will demonstrate how Reaxys Medicinal Chemistry and open source tools can be used to extract data from patents and journals, as well as create and validate quantitative structure-activity relationships (QSAR). In this webinar, Dr. Clark will provide insights into:

  • Creating models to predict binding based on chemical structure.
  • Sampling of data to create a more balanced data set from the published data.
  • Evaluating models at multiple levels of protein hierarchies.
  • Understanding the predictive ability of the models by creating orthogonal training and test sets for validation.

About the Speaker: Matt Clark Ph.D. is a Consultant for Elsevier where he works with pharmaceutical companies to deploy data integration, text mining, and custom bio-informatics solutions. While at Elsevier, Dr. Clark, has published research on the predictive ability of nonclinical studies to predict adverse events in clinical studies.