SIMPD: an algorithm for generating simulated time splits for validating machine learning approaches

Gregory A. Landrum, Maximilian Beckers, Jessica Lanini, Nadine Schneider, Nikolaus Stiefl, Sereina Riniker. SIMPD: an algorithm for generating simulated time splits for validating machine learning approaches. J. Cheminformatics, 15(1):119, December 2023. [doi]

Abstract

Abstract is missing.