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Human-in-the-loop active learning for goal-oriented molecule generation

Open access
DOI10.6084/m9.figshare.c.7577679.v1
Eva Nittinger, Janosch Menke, Jon Paul Janet, Julien Martinelli, Markus Heinonen, Mikhail Kabeshov, Ola Engkvist, Samuel Kaski, Yasmine Nahal2024
Open access
DOI10.6084/m9.figshare.c.7577679.v1
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Human-in-the-loop assisted de novo molecular design

Open access
DOI10.6084/m9.figshare.c.6582620
Alexey Voronov, Atanas Patronov, Esben Jannik Bjerrum, Haoping Xiao, Iiris Sundin, Kostas Papadopoulos, Markus Heinonen, Ola Engkvist, Samuel Kaski2024
Open access
DOI10.6084/m9.figshare.c.6582620
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Surface PEGylation suppresses pulmonary effects of CuO in allergen-induced lung inflammation

Open access
DOI10.6084/m9.figshare.c.4567376.v1
Alexandros Besinis, Harri Alenius, Henrik Wolff, Joanne Vassallo, Joseph Ndika, Kai Savolainen, Katrin Loeschner, Manuel Correia, Marit Ilves, Nicky Ehrlich, Pia Anneli Sofia Kinaret, Piia Karisola, Richard D. Handy, Vittorio Fortino, Yuri Fedutik, Dario Greco, Veer Marwah2019
Open access
DOI10.6084/m9.figshare.c.4567376.v1

Human-in-the-loop active learning for goal-oriented molecule generation

Open access
DOI10.6084/m9.figshare.c.7577679.v1
2024

Human-in-the-loop assisted de novo molecular design

Open access
DOI10.6084/m9.figshare.c.6582620
2024

Surface PEGylation suppresses pulmonary effects of CuO in allergen-induced lung inflammation

Open access
DOI10.6084/m9.figshare.c.4567376.v1
2019