MISATO: machine learning dataset of protein-ligand complexes for structure-based drug discovery. - Till Siebenmorgen; Filipe Menezes; Sabrina Benassou; Erinc Merdivan; Kieran Didi; André Santos Dias Mourão; Radoslaw Kitel; Pietro Liò; Stefan Kesselheim; Marie Piraud; Fabian J. Theis; Michael Sattler; et al. (Nat. Comput. Sci., 2024)