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Volodymyr V. Ivanov

affiliation not provided to SSRN

  • affiliation not provided to SSRN

SCHOLARLY PAPERS

2

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64

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Scholarly Papers (2)

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1.

IR Spectra of Proflavine in Complex with Polyethylene Glycol. Quantum Chemistry Investigation vs Experimental Data

Number of pages: 23 Posted: 17 Jan 2025
Eugen Dukhopelnikov, Ekaterina Bereznyak, Volodymyr V. Ivanov, Natalia Gladkovskaya, Iuliia Blyzniuk and Anna S. Khrebtova
affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 34 (1,263,436)

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Infrared spectra, Density functional theory calculations, B3LYP, proflavine, polyethylene glycol

2.

From ML300 to Novel Non-Covalent Inhibitors of SARS‑CoV‑2 Main Protease via Evolutionary de Novo Design, Virtual Screening, Molecular Dynamics, and Retrosynthetic Strategies

Number of pages: 58 Posted: 25 Sep 2025
Anna Geleverya, Alexander Kyrychenko, Larysa Yevsieieva, Volodymyr V. Ivanov, Volodymyr Fetyukhin, Sergiy M. Kovalenko and Oleg N. Kalugin
affiliation not provided to SSRN, affiliation not provided to SSRN, V. N. Karazin Kharkiv National University, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN and affiliation not provided to SSRN
Downloads 30 (1,332,057)

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heterocyclic compounds, coronavirus, COVID-19, main protease, Mpro, molecular docking