Revealing cytotoxic substructures in molecules using deep learning

Webel, Henry E. ; Kimber, Talia B. ; Radetzki, Silke ; Neuenschwander, Martin ; Nazaré, Marc ; Volkamer, Andrea

Journal of computer-aided molecular design, 2020-07, Vol.34 (7), p.731-746 [Periódico revisado por pares]

Cham: Springer International Publishing

Texto completo disponível