Alexander Zlobin

8PUBLICATIONS
25CO-AUTHORS
Energy generation, conversion and storage (excl. chemical and electrical)Electrochemical energy storage and conversionCatalysis and mechanisms of reactionsComputational chemistryLasers and quantum electronics
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Publications (8)

|Jun 19, 2026
Elliptical β-barrel deformation underlies gating in VDAC1.

|Feb 10, 2025
Long-Range Electrostatics in Serine Proteases: Machine Learning-Driven Reaction Sampling Yields Insights for Enzyme Design.

Alexander Zlobin, Valentina Maslova, Julia Beliaeva

|Jul 18, 2024
Dynamic interchange between two protonation states is characteristic of active sites of cholinesterases.

Alexander Zlobin, Ivan Smirnov, Andrey Golovin

|Feb 13, 2023
Modern non-polarizable force fields diverge in modeling the enzyme-substrate complex of a canonical serine protease.

Julia Belyaeva, Alexander Zlobin, Valentina Maslova

|Jan 12, 2023
Challenges in Protein QM/MM Simulations with Intra-Backbone Link Atoms.

Alexander Zlobin, Julia Belyaeva, Andrey Golovin

|Nov 17, 2022
Between Protein Fold and Nucleophile Identity: Multiscale Modeling of the TEV Protease Enzyme-Substrate Complex.

Alexander Zlobin, Andrey Golovin

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Frequent Collaborators

2 joint publications

Yuliana A Mokrushina

2 joint publications

Ivan V Smirnov

2 joint publications

Arthur Zalevsky

2 joint publications

Gleb Bourenkov