Lee AA - Search Results

1

Impedance-based forecasting of lithium-ion battery performance amid uneven usage.

Jones PK, Stimming U, Lee AA. Jones PK, et al. Among authors: lee aa. Nat Commun. 2022 Aug 16;13(1):4806. doi: 10.1038/s41467-022-32422-w. Nat Commun. 2022. PMID: 35974010 Free PMC article.

2

Identifying degradation patterns of lithium ion batteries from impedance spectroscopy using machine learning.

Zhang Y, Tang Q, Zhang Y, Wang J, Stimming U, Lee AA. Zhang Y, et al. Among authors: lee aa. Nat Commun. 2020 Apr 6;11(1):1706. doi: 10.1038/s41467-020-15235-7. Nat Commun. 2020. PMID: 32249782 Free PMC article.

3

Predicting materials properties without crystal structure: deep representation learning from stoichiometry.

Goodall REA, Lee AA. Goodall REA, et al. Among authors: lee aa. Nat Commun. 2020 Dec 8;11(1):6280. doi: 10.1038/s41467-020-19964-7. Nat Commun. 2020. PMID: 33293567 Free PMC article.

4

Quantitative interpretation explains machine learning models for chemical reaction prediction and uncovers bias.

Kovács DP, McCorkindale W, Lee AA. Kovács DP, et al. Among authors: lee aa. Nat Commun. 2021 Mar 16;12(1):1695. doi: 10.1038/s41467-021-21895-w. Nat Commun. 2021. PMID: 33727552 Free PMC article.

5

Bayesian unsupervised learning reveals hidden structure in concentrated electrolytes.

Jones P, Coupette F, Härtel A, Lee AA. Jones P, et al. Among authors: lee aa. J Chem Phys. 2021 Apr 7;154(13):134902. doi: 10.1063/5.0039617. J Chem Phys. 2021. PMID: 33832269

6

Data-driven discovery of molecular photoswitches with multioutput Gaussian processes.

Griffiths RR, Greenfield JL, Thawani AR, Jamasb AR, Moss HB, Bourached A, Jones P, McCorkindale W, Aldrick AA, Fuchter MJ, Lee AA. Griffiths RR, et al. Among authors: lee aa. Chem Sci. 2022 Nov 10;13(45):13541-13551. doi: 10.1039/d2sc04306h. eCollection 2022 Nov 23. Chem Sci. 2022. PMID: 36507171 Free PMC article.

7

Predictive Minisci late stage functionalization with transfer learning.

King-Smith E, Faber FA, Reilly U, Sinitskiy AV, Yang Q, Liu B, Hyek D, Lee AA. King-Smith E, et al. Among authors: lee aa. Nat Commun. 2024 Jan 15;15(1):426. doi: 10.1038/s41467-023-42145-1. Nat Commun. 2024. PMID: 38225239 Free PMC article.

8

Mechanistic insight into the chemical treatments of monolayer transition metal disulfides for photoluminescence enhancement.

Li Z, Bretscher H, Zhang Y, Delport G, Xiao J, Lee A, Stranks SD, Rao A. Li Z, et al. Nat Commun. 2021 Oct 18;12(1):6044. doi: 10.1038/s41467-021-26340-6. Nat Commun. 2021. PMID: 34663820 Free PMC article.

9

Molecular Transformer unifies reaction prediction and retrosynthesis across pharma chemical space.

Lee AA, Yang Q, Sresht V, Bolgar P, Hou X, Klug-McLeod JL, Butler CR. Lee AA, et al. Chem Commun (Camb). 2019 Oct 8;55(81):12152-12155. doi: 10.1039/c9cc05122h. Chem Commun (Camb). 2019. PMID: 31497831

10

Probing the chemical 'reactome' with high-throughput experimentation data.

King-Smith E, Berritt S, Bernier L, Hou X, Klug-McLeod JL, Mustakis J, Sach NW, Tucker JW, Yang Q, Howard RM, Lee AA. King-Smith E, et al. Among authors: lee aa. Nat Chem. 2024 Apr;16(4):633-643. doi: 10.1038/s41557-023-01393-w. Epub 2024 Jan 2. Nat Chem. 2024. PMID: 38168924 Free PMC article.

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