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Computational and Enzymatic Studies of Sartans in SARS-CoV-2 Spike RBD-ACE2 Binding: The Role of Tetrazole and Perspectives as Antihypertensive and COVID-19 Therapeutics.
Kelaidonis K, Ligielli I, Letsios S, Vidali VP, Mavromoustakos T, Vassilaki N, Moore GJ, Hoffmann W, Węgrzyn K, Ridgway H, Chasapis CT, Matsoukas JM. Kelaidonis K, et al. Among authors: moore gj. Int J Mol Sci. 2023 May 8;24(9):8454. doi: 10.3390/ijms24098454. Int J Mol Sci. 2023. PMID: 37176159 Free PMC article.
W254 in furin functions as a molecular gate promoting anti-viral drug binding: Elucidation of putative drug tunneling and docking by non-equilibrium molecular dynamics.
Ridgway H, Orbell JD, Matsoukas MT, Kelaidonis K, Moore GJ, Tsiodras S, Gorgoulis VG, Chasapis CT, Apostolopoulos V, Matsoukas JM. Ridgway H, et al. Among authors: moore gj. Comput Struct Biotechnol J. 2023 Sep 9;21:4589-4612. doi: 10.1016/j.csbj.2023.09.003. eCollection 2023. Comput Struct Biotechnol J. 2023. PMID: 37817778 Free PMC article.
Novel benzimidazole angiotensin receptor blockers with anti-SARS-CoV-2 activity equipotent to that of nirmatrelvir: computational and enzymatic studies.
Ridgway H, Moore GJ, Gadanec LK, Zulli A, Apostolopoulos V, Hoffmann W, Węgrzyn K, Vassilaki N, Mpekoulis G, Zouridakis M, Giastas P, Vidali VP, Kelaidonis K, Matsoukas MT, Dimitriou M, Mavromoustakos T, Tsiodras S, Gorgoulis VG, Karakasiliotis I, Chasapis CT, Matsoukas JM. Ridgway H, et al. Among authors: moore gj. Expert Opin Ther Targets. 2024 Jun 7:1-23. doi: 10.1080/14728222.2024.2362675. Online ahead of print. Expert Opin Ther Targets. 2024. PMID: 38828744
231 results