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Igor V Polyakov

7PUBLICATIONS
15CO-AUTHORS
Electrical energy generation (incl. renewables, excl. photovoltaics)Molecular targetsRadiation and matterMedical devicesBiomolecular modelling and design
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Journal

Publications (7)

Sort by Publication Date:
|Sep 13, 2025
Mechanism for Nucleotidyl Transfer in LINE-1 ORF2p Revealed by QM/MM Simulations.

Igor V Polyakov, Kirill D Miroshnichenko, Tatiana I Mulashkina

|Jan 11, 2025
Domain Mobility in the ORF2p Complex Revealed by Molecular Dynamics Simulations and Big Data Analysis.

Anna M Kulakova, Maria G Khrenova, Maria I Zvereva

|Dec 16, 2024
Systematic ab initio calculation of spectroscopic constants for A-reduced rotational effective Hamiltonians of asymmetric top molecules using normal ordering of cylindrical angular momentum operators.

Sergey V Krasnoshchekov, Ilya M Efremov, Igor V Polyakov

|Jul 08, 2024
A highly specific aptamer for the SARS-CoV-2 spike protein from the authentic strain.

Maria G Khrenova, Lyudmila Nikiforova, Fedor Grabovenko

|Jun 09, 2023
Multiscale Simulations of the Covalent Inhibition of the SARS-CoV-2 Main Protease: Four Compounds and Three Reaction Mechanisms.

Bella L Grigorenko, Igor V Polyakov, Maria G Khrenova

|Oct 19, 2022
Quantum-based Modeling of Protein-ligand Interaction: The Complex of RutA with Uracil and Molecular Oxygen.

Igor V Polyakov, Alexander V Nemukhin, Tatiana M Domratcheva

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Frequent Collaborators

3 joint publications

Maria G Khrenova

2 joint publications

Goran Giudetti

2 joint publications

Bella L Grigorenko

2 joint publications

Alexander V Nemukhin

2 joint publications

Anna I Krylov

2 joint publications

Anna M Kulakova

2 joint publications

Maria Zvereva

1 joint publications

Nadezhda Orlova

1 joint publications

Denis Kolesov

1 joint publications

Elena Zavyalova

Frequent Collaborators

3 joint publications

Maria G Khrenova

2 joint publications

Goran Giudetti

2 joint publications

Bella L Grigorenko

2 joint publications

Alexander V Nemukhin

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