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Importance of Electron Correlation on the Geometry and Electronic Structure of [2Fe-2S] Systems: A Benchmark Study of the [Fe2S2(SCH3)4]2-,3-,4-, [Fe2S2(SCys)4]2-, [Fe2S2(S-p-tol)4]2-, and [Fe2S2(S-o-xyl)4]2- Complexes.
Tzeli D, Golub P, Brabec J, Matoušek M, Pernal K, Veis L, Raugei S, Xantheas SS. Tzeli D, et al. J Chem Theory Comput. 2024 Dec 10;20(23):10406-10423. doi: 10.1021/acs.jctc.4c00781. Epub 2024 Nov 19. J Chem Theory Comput. 2024. PMID: 39561296
Exploring Hypertension: The Role of AT1 Receptors, Sartans, and Lipid Bilayers.
Georgiou N, Chontzopoulou E, Routsi EA, Stavrakaki IG, Petsas E, Zoupanou N, Kakava MG, Tzeli D, Mavromoustakos T, Kiriakidi S. Georgiou N, et al. Among authors: tzeli d. ACS Omega. 2024 Nov 1;9(45):44876-44890. doi: 10.1021/acsomega.4c06351. eCollection 2024 Nov 12. ACS Omega. 2024. PMID: 39554401 Free PMC article. Review.
Density functional theory and enzyme studies support interactions between angiotensin receptor blockers and angiotensin converting enzyme-2: Relevance to coronavirus 2019.
Apostolopoulos V, Georgiou N, Tzeli D, Mavromoustakos T, Moore GJ, Kelaidonis K, Matsoukas MT, Tsiodras S, Swiderski J, Kate Gadanec L, Zulli A, Chasapis CT, Matsoukas JM. Apostolopoulos V, et al. Among authors: tzeli d. Bioorg Chem. 2024 Sep;150:107602. doi: 10.1016/j.bioorg.2024.107602. Epub 2024 Jun 28. Bioorg Chem. 2024. PMID: 38959647 Free article.
62 results