CS

Martin Lepšík

mail martin.lepsikinvalid-email-name@invalid-email-domainuochb.cas.cz
phone +420 220 183 541
Hector Martinez-Seara Group
High Performance Computing
All publications

Latest publications

SQM2.20: Semiempirical quantum-mechanical scoring function yields DFT-quality protein–ligand binding affinity predictions in minutes
A. Pecina J. Fanfrlík M. Lepšík J. Řezáč
Nature Communications 15: 1127 (2024)
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Structural insights into the interaction between adenovirus C5 hexon and human lactoferrin
A. Dhillon B. D. Persson A. N. Volkov H. Sülzen A. Kádek P. Pompach S. Kereiche M. Lepšík K. Danskog C. Uetrecht N. Arnberg S. Zoll
Journal of Virology 2024: Early View
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Real-time Imaging of Nascent DNA in Live Cells by Monitoring the Fluorescence Lifetime of DNA-Incorporated Thiazole Orange-Modified Nucleotides
M. Kuba P. Khoroshyy M. Lepšík E. Kužmová D. Kodr T. Kraus M. Hocek
Angewandte Chemie International Edition 62 (38): e202307548 (2023)
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Powerful Avidity with a Limited Valency for Virus-Attachment Blockers on DC-SIGN: Combining Chelation and Statistical Rebinding with Structural Plasticity of the Receptor
V. Porkolab M. Lepšík S. Ordanini A. St John A. Le Roy M. Thépaut E. Paci C. Ebel A. Bernardi F. Fieschi
ACS Central Science 9 (4): 709–718 (2023)
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