An integrated structure- and system-based framework to identify new targets of metabolites and known drugs. - Hammad Naveed; Umar S. Hameed; Deborah Harrus; William Bourguet; Stefan T. Arold; Xin Gao 001 (Bioinform., 2015)

Towards accurate high-throughput ligand affinity prediction by exploiting structural ensembles, docking metrics and ligand similarity. - Melanie Schneider; Jean-Luc Pons; William Bourguet; Gilles Labesse (Bioinform., 2020)