Exploration of the Accessible Chemical Space of Acyclic Alkanes. - Robert S. Paton; Jonathan M. Goodman (J. Chem. Inf. Model., 2007)

Hydrogen Bonding and π-Stacking: How Reliable are Force Fields? A Critical Evaluation of Force Field Descriptions of Nonbonded Interactions. - Robert S. Paton; Jonathan M. Goodman (J. Chem. Inf. Model., 2009)

Multi-objective goal-directed optimization of de novo stable organic radicals for aqueous redox flow batteries. - Shree Sowndarya S. V.; Jeffrey N. Law; Charles Edison Tripp; Dmitry Duplyakin; Erotokritos Skordilis; David Biagioni; Robert S. Paton; Peter C. St. John (Nat. Mach. Intell., 2022)