Fuzzy Control in der Diabetestherapie. - Edgar Jacoby; Christian Zimmermann; Horst J. Bessai (Fuzzy Days, 1994)

An Ontology for Pharmaceutical Ligands and Its Application for in Silico Screening and Library Design. - Ansgar Schuffenhauer; Jürg Zimmermann; Ruedi Stoop; Jan-Jan van der Vyver; Steffano Lecchini; Edgar Jacoby (J. Chem. Inf. Comput. Sci., 2002)

Similarity Metrics for Ligands Reflecting the Similarity of the Target Proteins. - Ansgar Schuffenhauer; Philipp Floersheim; Pierre Acklin; Edgar Jacoby (J. Chem. Inf. Comput. Sci., 2003)

Comparison of Fingerprint-Based Methods for Virtual Screening Using Multiple Bioactive Reference Structures. - Jérôme Hert; Peter Willett 002; David J. Wilton; Pierre Acklin; Kamal Azzaoui; Edgar Jacoby; Ansgar Schuffenhauer (J. Chem. Inf. Model., 2004)

Sequential Superparamagnetic Clustering for Unbiased Classification of High-Dimensional Chemical Data. - Thomas Ott; Albert Kern; Ansgar Schuffenhauer; Maxim Popov; Pierre Acklin; Edgar Jacoby; Ruedi Stoop (J. Chem. Inf. Model., 2004)

New Scoring Functions for Virtual Screening from Molecular Dynamics Simulations with a Quantum-Refined Force-Field (QRFF-MD). Application to Cyclin-Dependent Kinase 2. - Philippe Ferrara; Alessandro Curioni; Eric Vangrevelinghe; T. Meyer; Tiziana Mordasini; Wanda Andreoni; Pierre Acklin; Edgar Jacoby (J. Chem. Inf. Model., 2006)

New Methods for Ligand-Based Virtual Screening: Use of Data Fusion and Machine Learning to Enhance the Effectiveness of Similarity Searching. - Jérôme Hert; Peter Willett 002; David J. Wilton; Pierre Acklin; Kamal Azzaoui; Edgar Jacoby; Ansgar Schuffenhauer (J. Chem. Inf. Model., 2006)

Relationships between Molecular Complexity, Biological Activity, and Structural Diversity. - Ansgar Schuffenhauer; Nathan Brown; Paul Selzer; Peter Ertl; Edgar Jacoby (J. Chem. Inf. Model., 2006)

Docking of ATP to Ca-ATPase: Considering Protein Domain Motions. - Timothy V. Pyrkov; Yuri A. Kosinsky; Alexander S. Arseniev; John P. Priestle; Edgar Jacoby; Roman G. Efremov (J. Chem. Inf. Model., 2007)

A Collection of Robust Organic Synthesis Reactions for In Silico Molecule Design. - Markus Hartenfeller; Martin Eberle; Peter Meier 002; Cristina Nieto-Oberhuber; Karl-Heinz Altmann; Gisbert Schneider; Edgar Jacoby; Steffen Renner (J. Chem. Inf. Model., 2011)

Probing the Bioactivity-Relevant Chemical Space of Robust Reactions and Common Molecular Building Blocks. - Markus Hartenfeller; Martin Eberle; Peter Meier 002; Cristina Nieto-Oberhuber; Karl-Heinz Altmann; Gisbert Schneider; Edgar Jacoby; Steffen Renner (J. Chem. Inf. Model., 2012)

Divide and Conquer. Pocket-Opening Mixed-Solvent Simulations in the Perspective of Docking Virtual Screening Applications for Drug Discovery. - Francesc Sabanés Zariquiey; Edgar Jacoby; Ann Vos; Herman W. T. van Vlijmen; Gary Tresadern; Jeremy N. Harvey (J. Chem. Inf. Model., 2022)