ZINC20 - A Free Ultralarge-Scale Chemical Database for Ligand Discovery. - John J. Irwin; Khanh G. Tang; Jennifer Young; Chinzorig Dandarchuluun; Benjamin R. Wong; Munkhzul Khurelbaatar; Yurii S. Moroz; John W. Mayfield; Roger A. Sayle (J. Chem. Inf. Model., 2020)

Property-Unmatched Decoys in Docking Benchmarks. - Reed M. Stein; Ying Yang; Trent E. Balius; Matt J. O'Meara; Jiankun Lyu; Jennifer Young; Khanh G. Tang; Brian K. Shoichet; John J. Irwin (J. Chem. Inf. Model., 2021)

ZINC-22─A Free Multi-Billion-Scale Database of Tangible Compounds for Ligand Discovery. - Benjamin I. Tingle; Khanh G. Tang; Mar Castanon; John J. Gutierrez; Munkhzul Khurelbaatar; Chinzorig Dandarchuluun; Yurii S. Moroz; John J. Irwin (J. Chem. Inf. Model., 2023)

DockOpt: A Tool for Automatic Optimization of Docking Models. - Ian S. Knight; Olivier Mailhot; Khanh G. Tang; John J. Irwin (J. Chem. Inf. Model., 2024)

A Database for Large-Scale Docking and Experimental Results. - Brendan W. Hall; Tia A. Tummino; Khanh G. Tang; Olivier Mailhot; Mar Castanon; John J. Irwin; Brian K. Shoichet (J. Chem. Inf. Model., 2025)