The de novo design of median molecules within a property range of interest. - Nathan Brown; Ben McKay; Johann Gasteiger (J. Comput. Aided Mol. Des., 2004)

A Graph-Based Genetic Algorithm and Its Application to the Multiobjective Evolution of Median Molecules. - Nathan Brown; Ben McKay; François Gilardoni; Johann Gasteiger (J. Chem. Inf. Model., 2004)

A novel workflow for the inverse QSPR problem using multiobjective optimization. - Nathan Brown; Ben McKay; Johann Gasteiger (J. Comput. Aided Mol. Des., 2006)