"Structure-Based Reaction Descriptors for Predicting Rate Constants by ..."

Yu Zhang et al. (2023)

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DOI: 10.1021/ACS.JCIM.3C00892

access: closed

type: Journal Article

metadata version: 2023-10-14

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  - https://dblp.org/rec/journals/jcisd/ZhangYSY23
Yu Zhang, Jinhui Yu, Hongwei Song, Minghui Yang:
Structure-Based Reaction Descriptors for Predicting Rate Constants by Machine Learning: Application to Hydrogen Abstraction from Alkanes by CH₃/H/O Radicals. J. Chem. Inf. Model. 63(16): 5097-5106 (2023)

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