MISATO: machine learning dataset of protein-ligand complexes for structure-based drug discovery.
Siebenmorgen T, Menezes F, Benassou S, Merdivan E, Didi K, Mourão ASD, Kitel R, Liò P, Kesselheim S, Piraud M, Theis FJ, Sattler M, Popowicz GM.
Siebenmorgen T, et al. Among authors: menezes f.
Nat Comput Sci. 2024 May 10. doi: 10.1038/s43588-024-00627-2. Online ahead of print.
Nat Comput Sci. 2024.
PMID: 38730184