Ian Berry & Bob Marmon (Evotec): Classification and analysis of 21 million compounds

ChemAxon
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Published on Jul 2, 2013

We will discuss how we classified and calculated properties for over 21 million commercially available compounds using a variety of ChemAxon and in-house tools (and aggregated properties). We will show a summary of the analysis of the data and show how we will use that to build better virtual screens.

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