Steven Shave

UFSRAT: Ultra-Fast Shape Recognition with Atom Types –The Discovery of Novel Bioactive Small Molecular Scaffolds for FKBP12 and 11βHSD1

Douglas R. Houston, Malcolm D. Walkinshaw, Paul Taylor, 2015, PloS one.

PuLSE: Quality control and quantification of peptide sequences explored by phage display libraries

Steven Shave, Manfred Auer, Stefan Mann, 2018, PloS one.

PyBindingCurve, Simulation, and Curve Fitting to Complex Binding Systems at Equilibrium

Steven Shave, Manfred Auer, Yan-Kai Chen, 2020, bioRxiv.

SimilarityLab: Molecular Similarity for SAR Exploration and Target Prediction on the Web

Steven Shave, Manfred Auer, M. Auer, 2021, Processes.