Human-in-the-loop assisted de novo molecular design - Voronov, Alexey; Xiao, Haoping; Papadopoulos, Kostas; Bjerrum, Esben Jannik; Heinonen, Markus; Patronov, Atanas; Kaski, Samuel; Engkvist; Ola; Sundin, Iiris (JOURNAL OF CHEMINFORMATICS, 2022)