Efficient iterative virtual screening with Apache Spark and conformal prediction

Laeeq Ahmed, Valentin Georgiev, Marco Capuccini, Salman Zubair Toor, Wesley Schaal, Erwin Laure, Ola Spjuth. Efficient iterative virtual screening with Apache Spark and conformal prediction. J. Cheminformatics, 10(1), 2018. [doi]

Abstract

Abstract is missing.