Benchmarking ML in ADMET predictions: the practical impact of feature representations in ligand-based models by Gintautas Kamuntavičius, Tanya Paquet, Orestis Bastas, Dainius Šalkauskas, Alvaro Prat, Hisham Abdel Aty, Aurimas Pabrinkis, Povilas Norvaišas, Roy Tal

Get full text