PoseBusters: AI-based docking methods fail to generate physically valid poses or generalise to novel sequences por Buttenschoen, M, Morris, GM, Deane, CM

Learnt representations of proteins can be used for accurate prediction of small molecule binding sites on experimentally determined and predicted protein structures por Carbery, A, Buttenschoen, M, Skyner, R, von Delft, F, Deane, CM