Human-in-the-loop assisted de novo molecular design - researchr publication authors

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Iiris Sundin, Alexey Voronov, Haoping Xiao, Kostas Papadopoulos, Esben Jannik Bjerrum, Markus Heinonen, Atanas Patronov, Samuel Kaski, Ola Engkvist. Human-in-the-loop assisted de novo molecular design. J. Cheminformatics, 14(1):86, 2022. [doi]

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