Virtual Compound Libraries: A New Approach to Decision Making in Molecular Discovery Research. - Richard D. Cramer; David E. Patterson; Robert D. Clark; Farhad Soltanshahi; Michael S. Lawless (J. Chem. Inf. Comput. Sci., 1998)

Using beta binomials to estimate classification uncertainty for ensemble models. - Robert D. Clark; Wenkel Liang; Adam C. Lee; Michael S. Lawless; Robert Fraczkiewicz; Marvin Waldman (J. Cheminformatics, 2014)

Design and tests of prospective property predictions for novel antimalarial 2-aminopropylaminoquinolones. - Robert D. Clark; Denise N. Morris; Gary Chinigo; Michael S. Lawless; Jacques Prudhomme; Karine G. Le Roch; Maria José Lafuente; Santiago Ferrer; Francisco Javier Gamo; Robert Gadwood; Walter S. Woltosz (J. Comput. Aided Mol. Des., 2020)

The AI-driven Drug Design (AIDD) platform: an interactive multi-parameter optimization system integrating molecular evolution with physiologically based pharmacokinetic simulations. - Jeremy Jones; Robert D. Clark; Michael S. Lawless; David W. Miller; Marvin Waldman (J. Comput. Aided Mol. Des., 2024)