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Taras Pogorelov

Profile picture for Taras  Pogorelov

Contact Information

Department of Chemistry
University of Illinois
Noyes Lab 150, Box 2-1, MC-712
600 South Mathews Ave
Urbana, IL 61801
Research Assistant Professor of Chemistry

Biography

Professor Pogorelov received a Diploma in Biomedical Engineering from Bauman Moscow State Technical University in 1995, an M.S. in Mathematics in 1996, and a Ph.D. in Chemical Physics in 2006 (with Zan Luthey-Schulten), both from the University of Illinois at Urbana-Champaign. From 2006 to 2009 he was a postdoctoral research associate in Chemistry Department (with Todd Martinez) and from 2009 to 2012 he was a postdoctoral research associate at the Beckman Institute (with Emad Tajkhorshid) and a Research Scientist at the School of Chemical Sciences. In 2012 he was appointed a Research Assistant Professor and a Senior Research Scientist in charge of scientific computing, where he advises and collaborates with the School’s researchers in the areas of advanced computational chemistry.

Research Description

Physical Chemistry of Complex Cellular Environments

We are physicists, chemists, biologists, and computer scientists, who address pressing questions in molecular biology and physical chemistry of the cell signaling in health and disease. We develop computational methods and workflows by combining frameworks of molecular dynamics, quantum chemistry, and molecular evolution with multi-resolution experimental data. Current emphasis is on cell signaling, protein dynamics and interactions in complex environments, and functional lipids in membrane-associated phenomena.

Additional Campus Affiliations

Research Assistant Professor, Beckman Institute
Fellow, National Center of Supercomputing Applications
Research Assistant Professor, School of Chemical Sciences
Research Assistant Professor of Biophysics

 

Recent Publications

Cheng, K. J., Shi, J., Pogorelov, T. V., & Capponi, S. (2024). Investigating the Bromoform Membrane Interactions Using Atomistic Simulations and Machine Learning: Implications for Climate Change Mitigation. Journal of Physical Chemistry B, 128(50), 12493-12506. https://doi.org/10.1021/acs.jpcb.4c04930

Samuel Russell, P. P., Maytin, A. K., Rickard, M. M., Russell, M. C., Pogorelov, T. V., & Gruebele, M. (2024). Metastable States in the Hinge-Bending Landscape of an Enzyme in an Atomistic Cytoplasm Simulation. Journal of Physical Chemistry Letters, 15(4), 940-946. https://doi.org/10.1021/acs.jpclett.3c03134

Scaletti, C., Russell, P. P. S., Hebel, K. J., Rickard, M. M., Boob, M., Danksagmüller, F., Taylor, S. A., Pogorelov, T. V., & Gruebele, M. (2024). Hydrogen bonding heterogeneity correlates with protein folding transition state passage time as revealed by data sonification. Proceedings of the National Academy of Sciences, 121(22), Article e2319094121. https://doi.org/10.1073/pnas.2319094121

Vasilev, C., Nguyen, J., Bowie, A. G. M., Mayneord, G. E., Martin, E. C., Hitchcock, A., Pogorelov, T. V., Singharoy, A., Hunter, C. N., & Johnson, M. P. (2024). Single-Molecule Detection of the Encounter and Productive Electron Transfer Complexes of a Photosynthetic Reaction Center. Journal of the American Chemical Society, 146(29), 20019-20032. https://doi.org/10.1021/jacs.4c03913

Boob, M. M., Sukenik, S., Gruebele, M., & Pogorelov, T. V. (2023). TMAO: Protecting proteins from feeling the heat. Biophysical journal, 122(7), 1414-1422. https://doi.org/10.1016/j.bpj.2023.03.008

View all publications on Illinois Experts