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Site-Averaged Ab Initio Kinetics: Importance Learning for Multistep Reactions on Amorphous Supports.
J Chem Theory Comput. 2023 May 23;19(10):2873-2886. doi: 10.1021/acs.jctc.3c00160. Epub 2023 Apr 24.
J Chem Theory Comput. 2023.
PMID: 37093705
Multiscale Models for Fibril Formation: Rare Events Methods, Microkinetic Models, and Population Balances.
Shayesteh Zadeh A, Peters B.
Shayesteh Zadeh A, et al.
Life (Basel). 2021 Jun 17;11(6):570. doi: 10.3390/life11060570.
Life (Basel). 2021.
PMID: 34204410
Free PMC article.
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