"BIreactive: A Machine-Learning Model to Estimate Covalent Warhead Reactivity."

Ferruccio Palazzesi et al. (2020)

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DOI: 10.1021/ACS.JCIM.9B01058

access: closed

type: Journal Article

metadata version: 2023-03-22

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Ferruccio Palazzesi, Markus R. Hermann, Marc A. Grundl, Alexander Pautsch, Daniel Seeliger, Christofer S. Tautermann, Alexander Weber:
BIreactive: A Machine-Learning Model to Estimate Covalent Warhead Reactivity. J. Chem. Inf. Model. 60(6): 2915-2923 (2020)

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