Chemprop v2: An Efficient, Modular Machine Learning Package for Chemical Property Prediction

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David E. Graff, Nathan K. Morgan, Jackson W. Burns, Anna C. Doner, Brian Li, Shih-Cheng Li, Joel Manu, Angiras Menon, Hao-Wei Pang, Haoyang Wu, Akshat Shirish Zalte, Jonathan W. Zheng, Connor W. Coley, William H. Green, Kevin P. Greenman

Published: 12 Jan 2026, Last Modified: 15 Feb 2026Journal of Chemical Information and ModelingEveryoneRevisionsCC BY-SA 4.0