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A Model Ensemble Approach Enables Data-Driven Property Prediction for Chemically Deconstructable Thermosets in the Low-Data Regime.
AlFaraj YS, Mohapatra S, Shieh P, Husted KEL, Ivanoff DG, Lloyd EM, Cooper JC, Dai Y, Singhal AP, Moore JS, Sottos NR, Gomez-Bombarelli R, Johnson JA. AlFaraj YS, et al. Among authors: mohapatra s. ACS Cent Sci. 2023 Sep 14;9(9):1810-1819. doi: 10.1021/acscentsci.3c00502. eCollection 2023 Sep 27. ACS Cent Sci. 2023. PMID: 37780353 Free PMC article.
Quantitative Mapping of Molecular Substituents to Macroscopic Properties Enables Predictive Design of Oligoethylene Glycol-Based Lithium Electrolytes.
Qiao B, Mohapatra S, Lopez J, Leverick GM, Tatara R, Shibuya Y, Jiang Y, France-Lanord A, Grossman JC, Gómez-Bombarelli R, Johnson JA, Shao-Horn Y. Qiao B, et al. Among authors: mohapatra s. ACS Cent Sci. 2020 Jul 22;6(7):1115-1128. doi: 10.1021/acscentsci.0c00475. Epub 2020 Jun 18. ACS Cent Sci. 2020. PMID: 32724846 Free PMC article.
Deep learning to design nuclear-targeting abiotic miniproteins.
Schissel CK, Mohapatra S, Wolfe JM, Fadzen CM, Bellovoda K, Wu CL, Wood JA, Malmberg AB, Loas A, Gómez-Bombarelli R, Pentelute BL. Schissel CK, et al. Among authors: mohapatra s. Nat Chem. 2021 Oct;13(10):992-1000. doi: 10.1038/s41557-021-00766-3. Epub 2021 Aug 9. Nat Chem. 2021. PMID: 34373596 Free PMC article.
Synthetic Glycomacromolecules of Defined Valency, Absolute Configuration, and Topology Distinguish between Human Lectins.
Hartweg M, Jiang Y, Yilmaz G, Jarvis CM, Nguyen HV, Primo GA, Monaco A, Beyer VP, Chen KK, Mohapatra S, Axelrod S, Gómez-Bombarelli R, Kiessling LL, Becer CR, Johnson JA. Hartweg M, et al. Among authors: mohapatra s. JACS Au. 2021 Aug 10;1(10):1621-1630. doi: 10.1021/jacsau.1c00255. eCollection 2021 Oct 25. JACS Au. 2021. PMID: 34723265 Free PMC article.
Bottlebrush polymers with flexible enantiomeric side chains display differential biological properties.
Nguyen HV, Jiang Y, Mohapatra S, Wang W, Barnes JC, Oldenhuis NJ, Chen KK, Axelrod S, Huang Z, Chen Q, Golder MR, Young K, Suvlu D, Shen Y, Willard AP, Hore MJA, Gómez-Bombarelli R, Johnson JA. Nguyen HV, et al. Among authors: mohapatra s. Nat Chem. 2022 Jan;14(1):85-93. doi: 10.1038/s41557-021-00826-8. Epub 2021 Nov 25. Nat Chem. 2022. PMID: 34824461 Free PMC article.
Design of Cytotoxic T Cell Epitopes by Machine Learning of Human Degrons.
Truex NL, Mohapatra S, Melo M, Rodriguez J, Li N, Abraham W, Sementa D, Touti F, Keskin DB, Wu CJ, Irvine DJ, Gómez-Bombarelli R, Pentelute BL. Truex NL, et al. Among authors: mohapatra s. bioRxiv [Preprint]. 2023 Sep 26:2023.08.22.554289. doi: 10.1101/2023.08.22.554289. bioRxiv. 2023. PMID: 37662211 Free PMC article. Updated. Preprint.
Design of Cytotoxic T Cell Epitopes by Machine Learning of Human Degrons.
Truex NL, Mohapatra S, Melo M, Rodriguez J, Li N, Abraham W, Sementa D, Touti F, Keskin DB, Wu CJ, Irvine DJ, Gómez-Bombarelli R, Pentelute BL. Truex NL, et al. Among authors: mohapatra s. ACS Cent Sci. 2024 Mar 6;10(4):793-802. doi: 10.1021/acscentsci.3c01544. eCollection 2024 Apr 24. ACS Cent Sci. 2024. PMID: 38680558 Free PMC article.
1,528 results