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Petr Jurečka

Basic information

CV

Publications

Teaching

Supervised theses

Projects

Academic degree, name, surname:

doc. RNDr. Petr Jurečka, Ph.D.

Room, floor, building:

M 302, Building M

Position:

Research interests and teaching:

Department (Faculty):

Department of Physics (Faculty of Science)

Phone number, mobile:

+420 553 46 2155

E-mail:

No record found.

Multistate B- to A- transition in protein-DNA Binding – How well is it described by current AMBER force fields?

Petr Jurečka, Marie Zgarbová, Filip Černý, Jan Salomon

Year: 2024, J BIOMOL STRUCT DYN

journal article

Assessing the Current State of Amber Force Field Modifications for DNA─2023 Edition

Olivia Love, Rodrigo Galindo-Murillo, Marie Zgarbová, Jiří Šponer, Petr Jurečka, Thomas E. Cheatham ... other authors

Year: 2023, JOURNAL OF CHEMICAL THEORY AND COMPUTATION

journal article

Dynamic and Nondynamic Electron Correlation Energy Decomposition Based on the Node of the Hartree–Fock Slater Determinant

Martin Šulka, Katarína Šulková, Petr Jurečka, Matúš Dubecký

Year: 2023, JOURNAL OF CHEMICAL THEORY AND COMPUTATION

journal article

Probabilistic Interpretation of NMR J-Couplings Determines BI–BII State Equilibria in DNA

Jiří Fukal, Marie Zgarbová, Petr Jurečka, Jakub Šebera, Vladimír Sychrovský

Year: 2022, JOURNAL OF CHEMICAL THEORY AND COMPUTATION

journal article

The Ad-MD method to calculate NMR shift including effects due to conformational dynamics: The 31P NMR shift in DNA

Jiří Fukal, Miloš Buděšínský, Ondřej Páv, Petr Jurečka, Marie Zgarbová, Jakub Šebera, Vladimír Sychrovský ... other authors

Year: 2022, J COMPUT CHEM

journal article

Conformational energies and equilibria of cyclic dinucleotidesin vacuoand in solution: computational chemistryvs.NMR experiments

Ondrej Gutten, Petr Jurečka, Zahra Aliakbar Tehrani, Miloš Buděšínský, Jan Řezáč, Lubomír Rulíšek ... other authors

Year: 2021, PHYS CHEM CHEM PHYS

journal article

Z-DNA as a Touchstone for Additive Empirical Force Fields and a Refinement of the Alpha/Gamma DNA Torsions for AMBER

Marie Zgarbová, Jiří Šponer, Petr Jurečka

Year: 2021, JOURNAL OF CHEMICAL THEORY AND COMPUTATION

journal article

(2009; 3 m) Pohang University of Science and Technology, Pohang, South Korea (Prof. K.S. Kim)

Petr Jurečka

Year: 2009

work experience abroad

(2006; 12 m) University of Calgary, Canada (Prof. Dennis Salahub)

Petr Jurečka

Year: 2006

work experience abroad

(2005; 3 m) Postdoctoral fellow, HPC Europa, SISSA/ISAS Trieste, Italy (prof. P. Carloni)

Petr Jurečka

Year: 2005

work experience abroad

(2002; 3 m) Pohang University of Science and Technology, Pohang (Prof. K.S. Kim)

Petr Jurečka

Year: 2002

work experience abroad

No record found.

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Simulace biomolekul a srovnání s exp.

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