title: Computational analysis of structure-activity relationships.
authors.affiliation: Novartis Institutes for BioMedical Research, Novartis Pharma AG, Forum 1, Novartis Campus, CH-4056 Basel, Switzerland.
authors.forename: Peter
authors.initials: P
authors.lastname: Gedeck
authors.forename: Christian
authors.initials: C
authors.lastname: Kramer
authors.forename: Peter
authors.initials: P
authors.lastname: Ertl
mesh_terms: D000818:Animals; D019295:Computational Biology / Q000379:methods*; D003198:Computer Simulation; D015195:Drug Design; D006801:Humans; D008958:Models, Molecular; D015233:Models, Statistical; D016571:Neural Networks, Computer; D021281:Quantitative Structure-Activity Relationship; D015203:Reproducibility of Results