prof. RNDr. Jiří Šponer, DrSc.

2023

• Atomistic Picture of Opening–Closing Dynamics of DNA Holliday Junction Obtained by Molecular Simulations

  ZHANG Zhengyue ŠPONER Jiří BUSSI Giovanni MLÝNSKÝ Vojtěch ŠULC Petr SIMMONS Chad R. STEPHANOPOULOS Nicholas KREPL Miroslav

  Article in Periodical

  Journal of Chemical Information and Modeling, year: 2023, volume: 63, edition: 9, DOI

• Structural and dynamic effects of pseudouridine modifications on noncanonical interactions in RNA

  VÖGELE Jennifer ZHANG Zhengyue DUCHARDT-FERNER Elke KRUSE Holger ZHANG Zhengyue ŠPONER Jiří KREPL Miroslav WÖHNERT Jens

  Article in Periodical

  RNA, year: 2023, volume: 29, edition: 6, DOI

2022

• Conformational Heterogeneity of RNA Stem-Loop Hairpins Bound to FUS-RNA Recognition Motif with Disordered RGG Tail Revealed by Unbiased Molecular Dynamics Simulations

  POKORNÁ Pavlína KREPL Miroslav CAMPAGNE Sébastien ŠPONER Jiří

  Article in Periodical

  Journal of Physical Chemistry B, year: 2022, volume: 126, edition: 45, DOI

• Lone-pair...π Contacts in Nucleic Acids: Revision of Lennard-Jones Parameters Needed

  MRÁZIKOVÁ Klaudia AUFFINGER Pascal ŠPONER Jiří KRUSE Holger

  Conference abstract

  Year: 2022, type: Conference abstract

• Photoinduced water-chromophore electron transfer causes formation of guanosine photodamage

  JANICKI Mikolaj J. SZABLA Rafal Kazimierz ŠPONER Jiří GORA Robert W.

  Article in Periodical

  Physical Chemistry Chemical Physics, year: 2022, volume: 24, edition: 14, DOI

• Quantum chemistry reveals AMBER force field shortcomings for anion…π contacts in nucleic acids

  MRÁZIKOVÁ Klaudia AUFFINGER Pascal KRUSE Holger MLÝNSKÝ Vojtěch ŠPONER Jiří

  Conference abstract

  Year: 2022, type: Conference abstract

• Spontaneous binding of single-stranded RNAs to RRM proteins visualized by unbiased atomistic simulations with a rescaled RNA force field

  KREPL Miroslav POKORNÁ Pavlína MLÝNSKÝ Vojtěch STADLBAUER Petr ŠPONER Jiří

  Article in Periodical

  Nucleic Acids Research, year: 2022, volume: 50, edition: 21, DOI

2021

• Insight into formation propensity of pseudocircular DNA G-hairpins

  LENARČIČ ŽIVKOVIĆ Martina GAJARSKÝ Martin BEKOVÁ Kateřina STADLBAUER P. VICHEREK Lukáš PETROVA M. FIALA Radovan ROSENBERG I. ŠPONER Jiří PLAVEC J. TRANTÍREK Lukáš

  Article in Periodical

  Nucleic acids research, year: 2021, volume: 49, edition: 4, DOI

• Nonenzymatic, Template-Free Polymerization of 3',5' Cyclic Guanosine Monophosphate on Mineral Surfaces

  ŠPONEROVÁ Judit ŠPONER Jiří VÝRAVSKÝ Jakub ŠEDO Ondrej ZDRÁHAL Zbyněk COSTANZO Giovanna DI MAURO Ernesto WUNNAVA Sreekar BRAUN Dieter MATYÁŠEK Roman KOVAŘÍK Aleš

  Article in Periodical

  ChemSystemsChem, year: 2021, volume: 3, edition: 6, DOI

• Phosphorothioate Substitutions in RNA Structure Studied by Molecular Dynamics Simulations, QM/MM Calculations, and NMR Experiments

  ZHANG Zhengyue VOGELE J. MRÁZIKOVÁ Klaudia KRUSE H. CANG X.H. WOHNERT J. KREPL M. ŠPONER Jiří

  Article in Periodical

  Journal of Physical Chemistry B, year: 2021, volume: 125, edition: 3, DOI