Shaping a Screening File for Maximal Lead Discovery Efficiency and Effectiveness: Elimination of Molecular Redundancy. - Gregory A. Bakken; Andrew Bell; Markus Boehm; Jeremy R. Everett; Rosalia Gonzales; David Hepworth; Jacquelyn L. Klug-McLeod; Jeremy Lanfear; Jens Loesel; John Mathias; Terence P. Wood (J. Chem. Inf. Model., 2012)