Chemprop: A Machine Learning Package for Chemical Property Prediction

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Esther Heid, Kevin P. Greenman, Yunsie Chung, Shih-Cheng Li, David E. Graff, Florence H. Vermeire, Haoyang Wu, William H. Green Jr., Charles McGill

Published: 01 Jan 2024, Last Modified: 11 Jun 2024J. Chem. Inf. Model. 2024EveryoneRevisionsBibTeXCC BY-SA 4.0
Abstract: Abstract