Selecting compounds for focused screening using linear discriminant analysis and artificial neural networks.


Linear discriminant analysis and a committee of neural networks have been applied to recognise compounds that act at biological targets belonging to a specific gene family, protein kinases. The MDDR database was used to provide compounds targeted against this family and sets of randomly selected molecules. BCUT parameters were employed as input descriptors… (More)


Figures and Tables

Sorry, we couldn't extract any figures or tables for this paper.