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Computational studies on potential new anti-Covid-19 agents with a multi-target mode of action.
Mohapatra RK, Azam M, Mohapatra PK, Sarangi AK, Abdalla M, Perekhoda L, Yadav O, Al-Resayes SI, Jong-Doo K, Dhama K, Ansari A, Seidel V, Verma S, Raval MK. Mohapatra RK, et al. Among authors: perekhoda l. J King Saud Univ Sci. 2022 Jul;34(5):102086. doi: 10.1016/j.jksus.2022.102086. Epub 2022 May 13. J King Saud Univ Sci. 2022. PMID: 35582633 Free PMC article.
Computational investigations of three main drugs and their comparison with synthesized compounds as potent inhibitors of SARS-CoV-2 main protease (Mpro): DFT, QSAR, molecular docking, and in silico toxicity analysis.
Mohapatra RK, Perekhoda L, Azam M, Suleiman M, Sarangi AK, Semenets A, Pintilie L, Al-Resayes SI. Mohapatra RK, et al. Among authors: perekhoda l. J King Saud Univ Sci. 2021 Mar;33(2):101315. doi: 10.1016/j.jksus.2020.101315. Epub 2020 Dec 27. J King Saud Univ Sci. 2021. PMID: 33390681 Free PMC article.
Synthesis, X-ray diffraction study, analysis of inter-molecular inter-actions and mol-ecular docking of ethyl 1-(3-tosyl-quinolin-4-yl)piperidine-4-carboxyl-ate.
Vaksler Y, Hryhoriv HV, Kovalenko SM, Perekhoda LO, Georgiyants VA. Vaksler Y, et al. Among authors: perekhoda lo. Acta Crystallogr E Crystallogr Commun. 2022 Aug 9;78(Pt 9):890-896. doi: 10.1107/S2056989022007691. eCollection 2022 Sep 1. Acta Crystallogr E Crystallogr Commun. 2022. PMID: 36072518 Free PMC article.
Modern trends in diuretics development.
Titko T, Perekhoda L, Drapak I, Tsapko Y. Titko T, et al. Among authors: perekhoda l. Eur J Med Chem. 2020 Dec 15;208:112855. doi: 10.1016/j.ejmech.2020.112855. Epub 2020 Sep 19. Eur J Med Chem. 2020. PMID: 33007663 Review.
Synthesis, docking, and biological evaluation of novel 1-benzyl-4-(4-(R)-5-sulfonylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl)pyrrolidin-2-ones as potential nootropic agents.
Semenets AP, Suleiman MM, Fedosov AI, Shtrygol SY, Havrylov IO, Mishchenko MV, Kovalenko SM, Georgiyants VA, Perekhoda LO. Semenets AP, et al. Among authors: perekhoda lo. Eur J Med Chem. 2022 Dec 15;244:114823. doi: 10.1016/j.ejmech.2022.114823. Epub 2022 Oct 7. Eur J Med Chem. 2022. PMID: 36274278