John W. Liebeschuetz

Pose prediction and virtual screening performance of GOLD scoring functions in a standardized test

John W. Liebeschuetz, Jason C. Cole, Oliver Korb · Journal of Computer-Aided Molecular Design · 2012 · 178 citations

Computing, Bioinformatics, Computer Science +10

Potential and Limitations of Ensemble Docking

Oliver Korb, Tjelvar S. G. Olsson, Simon J. Bowden et al. · Journal of Chemical Information and Modeling · 2012 · 170 citations

Life Sciences, Medicinal Chemistry, Drug Discovery +16

The good, the bad and the twisted: a survey of ligand geometry in protein crystal structures

John W. Liebeschuetz, Jana Hennemann, Tjelvar S. G. Olsson et al. · Journal of Computer-Aided Molecular Design · 2012 · 108 citations · Full text

Life Sciences, Biochemistry, Biomolecular Modeling +14

PRO_SELECT:  Combining Structure-Based Drug Design and Array-Based Chemistry for Rapid Lead Discovery. 2. The Development of a Series of Highly Potent and Selective Factor Xa Inhibitors

John W. Liebeschuetz, Stuart Jones, Phillip J. Morgan et al. · Journal of Medicinal Chemistry · 2002 · 85 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

The Hydrogen Bond Environments of 1<i>H</i>-Tetrazole and Tetrazolate Rings: The Structural Basis for Tetrazole–Carboxylic Acid Bioisosterism

Frank H. Allen, Colin R. Groom, John W. Liebeschuetz et al. · Journal of Chemical Information and Modeling · 2012 · 72 citations

Pharmacy, Chemistry, Medicinal Chemistry +17