van der Waals Surface Graphs and the Shape of Small Rings. - David C. Whitley (J. Chem. Inf. Comput. Sci., 1998)

Use of Automatic Relevance Determination in QSAR Studies Using Bayesian Neural Networks. - Frank R. Burden; Martyn G. Ford; David C. Whitley; David A. Winkler (J. Chem. Inf. Comput. Sci., 2000)

Unsupervised Forward Selection: A Method for Eliminating Redundant Variables. - David C. Whitley; Martyn G. Ford; David J. Livingstone (J. Chem. Inf. Comput. Sci., 2000)

Selecting Screening Candidates for Kinase and G Protein-Coupled Receptor Targets Using Neural Networks. - David T. Manallack; Will R. Pitt; Emanuela Gancia; John G. Montana; David J. Livingstone; Martyn G. Ford; David C. Whitley (J. Chem. Inf. Comput. Sci., 2002)

A Consensus Neural Network-Based Technique for Discriminating Soluble and Poorly Soluble Compounds. - David T. Manallack; Benjamin G. Tehan; Emanuela Gancia; Brian D. Hudson; Martyn G. Ford; David J. Livingstone; David C. Whitley; Will R. Pitt (J. Chem. Inf. Comput. Sci., 2003)

Biological data mining with neural networks: implementation and application of a flexible decision tree extraction algorithm to genomic problem domains. - Antony Browne; Brian D. Hudson; David C. Whitley; Martyn G. Ford; Phil D. Picton (Neurocomputing, 2004)

The Extraction of Information and Knowledge from Trained Neural Networks. - David J. Livingstone; Antony Browne; Raymond Crichton; Brian D. Hudson; David C. Whitley; Martyn G. Ford (Artificial Neural Networks, 2009)

Sharpening the Toolbox of Computational Chemistry: A New Approximation of Critical F-Values for Multiple Linear Regression. - Christian Kramer; Christofer S. Tautermann; David J. Livingstone; David W. Salt; David C. Whitley; Bernd Beck; Timothy Clark (J. Chem. Inf. Model., 2009)

APTE: identification of indirect read-out A-DNA promoter elements in genomes. - David C. Whitley; Valeria Runfola; Peter Cary; Liliya Nazlamova; Matt Guille; Garry Scarlett (BMC Bioinform., 2014)

Can Simulations and Modeling Decipher NMR Data for Conformational Equilibria? Arginine-Vasopressin. - Elke Haensele; Noureldin Saleh; Christopher M. Read; Lee Banting; David C. Whitley; Timothy Clark (J. Chem. Inf. Model., 2016)

Conformation and Dynamics of Human Urotensin II and Urotensin Related Peptide in Aqueous Solution. - Elke Haensele; Nawel Mele; Marija Miljak; Christopher M. Read; David C. Whitley; Lee Banting; Carla Delépée; Jana Sopkova-de Oliveira Santos; Alban Lepailleur; Ronan Bureau; Jonathan W. Essex; Timothy Clark (J. Chem. Inf. Model., 2017)