Molecular surface-volume and property matching to superpose flexible dissimilar molecules. - Tim D. J. Perkins; J. E. J. Mills; Philip M. Dean (J. Comput. Aided Mol. Des., 1995)

Three-dimensional hydrogen-bond geometry and probability information from a crystal survey. - J. E. J. Mills; Philip M. Dean (J. Comput. Aided Mol. Des., 1996)

An automated method for predicting the positions of hydrogen-bonding atoms in binding sites. - J. E. J. Mills; Tim D. J. Perkins; Philip M. Dean (J. Comput. Aided Mol. Des., 1997)

Slate: A method for the superposition of flexible ligands. - J. E. J. Mills; Iwan J. P. de Esch; Tim D. J. Perkins; Philip M. Dean (J. Comput. Aided Mol. Des., 2001)

Enhanced HTS Hit Selection via a Local Hit Rate Analysis. - Bruce A. Posner; Hualin Xi; James E. J. Mills (J. Chem. Inf. Model., 2009)

High-Throughput Virtual Screening of Proteins Using GRID Molecular Interaction Fields. - Simone Sciabola; Robert V. Stanton; James E. J. Mills; Maria M. Flocco; Massimo Baroni; Gabriele Cruciani; Francesca Perruccio; Jonathan S. Mason (J. Chem. Inf. Model., 2010)

Design of a multi-purpose fragment screening library using molecular complexity and orthogonal diversity metrics. - Wan F. Lau; Jane M. Withka; David Hepworth; Thomas V. Magee; Yuhua J. Du; Gregory A. Bakken; Michael D. Miller; Zachary S. Hendsch; Venkataraman Thanabal; Steve A. Kolodziej; Li Xing; Qiyue Hu; et al. (J. Comput. Aided Mol. Des., 2011)