RESEARCH PAPER · Science · 2023
Autonomous, multiproperty-driven molecular discovery: From predictions to measurements and back
Brent A. Koscher, Richard B. Canty, Matthew A. McDonald, Kevin P. Greenman, Charles J. McGill, Camille Bilodeau, Wengong Jin, Haoyang Wu, Florence H. Vermeire, Brooke Jin, Travis Hart, Timothy Kulesza, Shih‐Cheng Li, Tommi Jaakkola, Regina Barzilay, Rafael Gómez‐Bombarelli, William H. Green, Klavs F. Jensen
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