The (Re)-Evolution of Quantitative Structure-Activity Relationship (QSAR) Studies Propelled by the Surge of Machine Learning Methods.

Abstract

Authors

• Thereza A Soares
  Department of Chemistry, University of São Paulo, Ribeirão Preto 055508-090, Brazil.
• Ariane Nunes-Alves
  Institute of Chemistry, Technische Universität Berlin, Berlin 10623, Germany.
• Angelica Mazzolari
  Dipartimento di Scienze Farmaceutiche Università degli Studi di Milano, Milan, Italy.
• Fiorella Ruggiu
  Insitro Inc., 279 East Grand Avenue, South San Francisco 94080, California, United States.
• Guo-Wei Wei
  Department of Mathematics, Department of Electrical and Computer Engineering, Department of Biochemistry and Molecular Biology, Michigan State University, MI 48824, USA.
• Kenneth Merz
  Department of Chemistry, Michigan State University, East Lansing 48824, Michigan, United States.

Keywords

External Resources