Maria Kurnikova
Affiliations: | Carnegie Mellon University, Pittsburgh, PA |
Area:
Physical Chemistry, General BiophysicsGoogle:
"Maria Kurnikova"Mean distance: (not calculated yet)
Parents
Sign in to add mentor| Rob D. Coalson | grad student | 1998 | University of Pittsburgh (Astronomy Tree) |
Children
Sign in to add trainee| Kirill Speranskiy | grad student | 2007 | Carnegie Mellon |
| Nikolay Simakov | grad student | 2010 | Carnegie Mellon |
| Michael J. Yonkunas | grad student | 2010 | Carnegie Mellon |
BETA: Related publications
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Publications
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| Koby SB, Gutkin E, Patel S, et al. (2025) Automated On-the-Fly Optimization of Resource Allocation for Efficient Free Energy Simulations. Journal of Chemical Information and Modeling |
| Gangwar SP, Yelshanskaya MV, Aktolun M, et al. (2024) Trapping of spermine, Kukoamine A, and polyamine toxin blockers in GluK2 kainate receptor channels. Nature Communications. 15: 10257 |
| Li F, Ackloo S, Arrowsmith CH, et al. (2024) CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson's Disease Associated Protein. Journal of Chemical Information and Modeling |
| Xue S, Tang Y, Kurnikov IV, et al. (2024) Spectroscopic and computational studies of a bifunctional iron- and 2-oxoglutarate dependent enzyme, AsqJ. Methods in Enzymology. 704: 199-232 |
| Gutkin E, Gusev F, Gentile F, et al. (2024) screening of LRRK2 WDR domain inhibitors using deep docking and free energy simulations. Chemical Science. 15: 8800-8812 |
| Gangwar SP, Yelshanskaya MV, Nadezhdin KD, et al. (2024) Kainate receptor channel opening and gating mechanism. Nature |
| Nadezhdin KD, Correia L, Shalygin A, et al. (2024) Structural basis of selective TRPM7 inhibition by the anticancer agent CCT128930. Cell Reports. 43: 114108 |
| Khoreva A, Butov KR, Nikolaeva EI, et al. (2023) Novel hemizygous variant leads to combined immunodeficiency with defective platelet calcium signaling and cell mobility. The Journal of Allergy and Clinical Immunology. Global. 3: 100172 |
| Illarionov A, Sakipov S, Pereyaslavets L, et al. (2023) Combining Force Fields and Neural Networks for an Accurate Representation of Chemically Diverse Molecular Interactions. Journal of the American Chemical Society. 145: 23620-23629 |
| Schimunek J, Seidl P, Elez K, et al. (2023) A community effort in SARS-CoV-2 drug discovery. Molecular Informatics |