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Computationally driven discovery of SARS-CoV-2 Mpro inhibitors: from design to experimental validation.
Chem Sci. 2022 Feb 10;13(13):3674-3687. doi: 10.1039/d1sc05892d. eCollection 2022 Mar 30.
Chem Sci. 2022.
PMID: 35432906
Free PMC article.
A new inactive conformation of SARS-CoV-2 main protease.
Fornasier E, Macchia ML, Giachin G, Sosic A, Pavan M, Sturlese M, Salata C, Moro S, Gatto B, Bellanda M, Battistutta R.
Fornasier E, et al. Among authors: macchia ml.
Acta Crystallogr D Struct Biol. 2022 Mar 1;78(Pt 3):363-378. doi: 10.1107/S2059798322000948. Epub 2022 Feb 21.
Acta Crystallogr D Struct Biol. 2022.
PMID: 35234150
Free PMC article.
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EHDTA: a green approach to efficient Ln3+-chelators.
Travagin F, Macchia ML, Grell T, Bodnár J, Baranyai Z, Artizzu F, Botta M, Giovenzana GB.
Travagin F, et al. Among authors: macchia ml.
Dalton Trans. 2024 Jan 23;53(4):1779-1793. doi: 10.1039/d3dt03292b.
Dalton Trans. 2024.
PMID: 38170858
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