Predicting molecular docking of per- and polyfluoroalkyl substances to blood protein using generative artificial intelligence algorithm DiffDock - B Fortela, Dhan Lord; Mikolajczyk, Ashley P; Carnes, Miranda R; Sharp, Wayne; Revellame, Emmanuel; Hernandez, Rafael; Holmes, William E; Zappi, Mark E (BioTechniques, 2024)
Keywords: Algorithms; Artificial Intelligence; Blood Proteins; Fluorocarbons; generative artificial intelligence; human health; Humans; molecular docking; Molecular Docking Simulation; per- and polyfluoroalkyl substances; target-based screening; molecular docking; per- and polyfluoroalkyl substances; blood proteins; generative artificial intelligence; human health; target-based screening