Jan Řezáč

11.9k total citations · 4 hit papers
123 papers, 8.7k citations indexed

About

Jan Řezáč is a scholar working on Atomic and Molecular Physics, and Optics, Molecular Biology and Physical and Theoretical Chemistry. According to data from OpenAlex, Jan Řezáč has authored 123 papers receiving a total of 8.7k indexed citations (citations by other indexed papers that have themselves been cited), including 58 papers in Atomic and Molecular Physics, and Optics, 47 papers in Molecular Biology and 47 papers in Physical and Theoretical Chemistry. Recurrent topics in Jan Řezáč's work include Advanced Chemical Physics Studies (49 papers), Crystallography and molecular interactions (40 papers) and Protein Structure and Dynamics (34 papers). Jan Řezáč is often cited by papers focused on Advanced Chemical Physics Studies (49 papers), Crystallography and molecular interactions (40 papers) and Protein Structure and Dynamics (34 papers). Jan Řezáč collaborates with scholars based in Czechia, United States and France. Jan Řezáč's co-authors include Pavel Hobza, Kevin E. Riley, Michal Pitoňák, Jindřich Fanfrlík, Dennis R. Salahub, Aurélien de la Lande, Jiří Hostaš, Kristian Kříž, Martin Lepšı́k and Róbert Sedlák and has published in prestigious journals such as Chemical Reviews, Proceedings of the National Academy of Sciences and Journal of the American Chemical Society.

In The Last Decade

Jan Řezáč

120 papers receiving 8.6k citations

Hit Papers

S66: A Well-balanced Database of Benchmark Interaction En... 2011 2026 2016 2021 2011 2011 2016 2013 250 500 750

Peers — A (Enhanced Table)

Peers by citation overlap · career bar shows stage (early→late) cites · hero ref

Name h Career Trend Papers Cites
Jan Řezáč Czechia 47 3.9k 3.1k 2.8k 2.0k 1.8k 123 8.7k
Jean‐Philip Piquemal France 51 4.2k 1.1× 3.0k 1.0× 2.9k 1.1× 3.1k 1.5× 2.9k 1.7× 192 12.0k
Kevin E. Riley United States 35 3.0k 0.8× 4.3k 1.4× 2.1k 0.8× 1.2k 0.6× 2.0k 1.1× 70 7.7k
G. Narahari Sastry India 47 1.8k 0.5× 2.3k 0.7× 2.6k 0.9× 2.5k 1.2× 4.2k 2.4× 311 10.2k
Dmitri G. Fedorov Japan 47 5.2k 1.3× 1.4k 0.4× 2.0k 0.7× 2.9k 1.4× 1.1k 0.6× 187 8.9k
Kazuo Kitaura Japan 52 5.7k 1.5× 2.3k 0.7× 2.3k 0.8× 4.0k 1.9× 2.7k 1.5× 166 12.0k
Edward G. Hohenstein United States 45 4.1k 1.1× 2.2k 0.7× 2.0k 0.7× 988 0.5× 1.4k 0.8× 76 7.8k
Shridhar R. Gadre India 52 4.7k 1.2× 3.1k 1.0× 1.6k 0.6× 812 0.4× 2.9k 1.6× 258 8.9k
Petr Jurečka Czechia 41 3.4k 0.9× 2.4k 0.8× 2.4k 0.9× 5.6k 2.8× 1.6k 0.9× 85 10.9k
Patrick Bultinck Belgium 48 3.1k 0.8× 1.5k 0.5× 2.0k 0.7× 879 0.4× 3.5k 2.0× 222 8.1k
John M. Herbert United States 56 5.2k 1.3× 2.5k 0.8× 2.0k 0.7× 1.1k 0.6× 1.4k 0.8× 212 8.6k

Countries citing papers authored by Jan Řezáč

Since Specialization
Citations

This map shows the geographic impact of Jan Řezáč's research. It shows the number of citations coming from papers published by authors working in each country. You can also color the map by specialization and compare the number of citations received by Jan Řezáč with the expected number of citations based on a country's size and research output (numbers larger than one mean the country cites Jan Řezáč more than expected).

Fields of papers citing papers by Jan Řezáč

Since Specialization
Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Jan Řezáč. Nodes represent research fields, and links connect fields that are likely to share authors. Colored nodes show fields that tend to cite the papers produced by Jan Řezáč. The network helps show where Jan Řezáč may publish in the future.

Co-authorship network of co-authors of Jan Řezáč

This figure shows the co-authorship network connecting the top 25 collaborators of Jan Řezáč. A scholar is included among the top collaborators of Jan Řezáč based on the total number of citations received by their joint publications. Widths of edges represent the number of papers authors have co-authored together. Node borders signify the number of papers an author published with Jan Řezáč. Jan Řezáč is excluded from the visualization to improve readability, since they are connected to all nodes in the network.

All Works

20 of 20 papers shown
1.
Slavětínská, Lenka Poštová, Martin Lepšı́k, Jan Řezáč, et al.. (2025). Potent Competitive Inhibitors of Ecto-5′-nucleotidase (CD73) based on 6-(Het)aryl-7-deazapurine Ribonucleoside 5′- O -Bisphosphonates. ACS Pharmacology & Translational Science. 9(1). 191–213.
2.
Jalaie, Mehran, Jindřich Fanfrlík, Adam Pecina, Martin Lepšı́k, & Jan Řezáč. (2025). Comparative Analysis of Quantum-Mechanical and Standard Single-Structure Protein–Ligand Scoring Functions with MD-Based Free Energy Calculations. Journal of Chemical Information and Modeling. 65(15). 8127–8136. 1 indexed citations
3.
Pecina, Adam, Jindřich Fanfrlík, Martin Lepšı́k, & Jan Řezáč. (2024). SQM2.20: Semiempirical quantum-mechanical scoring function yields DFT-quality protein–ligand binding affinity predictions in minutes. Nature Communications. 15(1). 1127–1127. 29 indexed citations
4.
Dohnálek, Jan, Jana Škerlová, Stancho Stanchev, et al.. (2024). Extensive targeting of chemical space at the prime side of ketoamide inhibitors of rhomboid proteases by branched substituents empowers their selectivity and potency. European Journal of Medicinal Chemistry. 275. 116606–116606. 2 indexed citations
5.
Řezáč, Jan & Aurélien de la Lande. (2023). On the Role of Charge Transfer in Many‐Body Non‐Covalent Interactions**. ChemPhysChem. 24(18). e202300329–e202300329. 2 indexed citations
6.
Greenwell, Chandler, Jan Řezáč, & Gregory J. O. Beran. (2022). Spin-component-scaled and dispersion-corrected second-order Møller–Plesset perturbation theory: a path toward chemical accuracy. Physical Chemistry Chemical Physics. 24(6). 3695–3712. 22 indexed citations
7.
Hostaš, Jiří & Jan Řezáč. (2017). Accurate DFT-D3 Calculations in a Small Basis Set. Journal of Chemical Theory and Computation. 13(8). 3575–3585. 95 indexed citations
8.
Becucci, Maurizio, et al.. (2017). Non-covalent interactions in anisole–(CO2)n (n = 1, 2) complexes. Physical Chemistry Chemical Physics. 19(34). 22749–22758. 2 indexed citations
9.
Řezáč, Jan, Dana Nachtigallová, Massimiliano Pasquini, et al.. (2015). Binding Energies of the π‐Stacked Anisole Dimer: New Molecular Beam—Laser Spectroscopy Experiments and CCSD(T) Calculations. Chemistry - A European Journal. 21(18). 6740–6746. 17 indexed citations
10.
Riley, Kevin E., Jan Řezáč, & Pavel Hobza. (2013). Competition between halogen, dihalogen and hydrogen bonds in bromo- and iodomethanol dimers. Journal of Molecular Modeling. 19(7). 2879–2883. 19 indexed citations
11.
Ferrer, Sı́lvia, Jan Řezáč, Olivier Parisel, et al.. (2013). Investigation of the Hydroxylation Mechanism of Noncoupled Copper Oxygenases by Ab Initio Molecular Dynamics Simulations. Chemistry - A European Journal. 19(51). 17328–17337. 18 indexed citations
12.
Lepšı́k, Martin, Jan Řezáč, Michal H. Kolář, et al.. (2013). The Semiempirical Quantum Mechanical Scoring Function for In Silico Drug Design. ChemPlusChem. 78(9). 921–931. 74 indexed citations
13.
Houée‐Levin, Chantal, Jan Řezáč, Bernard C. Levy, et al.. (2012). New insights into the mechanism of electron transfer within flavohemoglobins: tunnelling pathways, packing density, thermodynamic and kinetic analyses. Physical Chemistry Chemical Physics. 14(40). 13872–13872. 19 indexed citations
14.
Riley, Kevin E., Jane S. Murray, Jindřich Fanfrlík, et al.. (2011). Halogen bond tunability I: the effects of aromatic fluorine substitution on the strengths of halogen-bonding interactions involving chlorine, bromine, and iodine. Journal of Molecular Modeling. 17(12). 3309–3318. 365 indexed citations
15.
Řezáč, Jan, Kevin E. Riley, & Pavel Hobza. (2011). Evaluation of the performance of post‐Hartree‐Fock methods in terms of intermolecular distance in noncovalent complexes. Journal of Computational Chemistry. 33(6). 691–694. 16 indexed citations
16.
Dobeš, Petr, Jindřich Fanfrlík, Jan Řezáč, Michal Otyepka, & Pavel Hobza. (2011). Transferable scoring function based on semiempirical quantum mechanical PM6-DH2 method: CDK2 with 15 structurally diverse inhibitors. Journal of Computer-Aided Molecular Design. 25(3). 223–235. 45 indexed citations
17.
Riley, Kevin E., Jan Řezáč, & Pavel Hobza. (2011). MP2.X: a generalized MP2.5 method that produces improved binding energies with smaller basis sets. Physical Chemistry Chemical Physics. 13(47). 21121–21121. 40 indexed citations
18.
Řezáč, Jan, Pavel Hobza, & Sarah A. Harris. (2010). Stretched DNA Investigated Using Molecular-Dynamics and Quantum-Mechanical Calculations. Biophysical Journal. 98(1). 101–110. 17 indexed citations
19.
Pitoňák, Michal, Jan Řezáč, & Pavel Hobza. (2010). Spin-component scaled coupled-clusters singles and doubles optimized towards calculation of noncovalent interactions. Physical Chemistry Chemical Physics. 12(33). 9611–9611. 59 indexed citations
20.
Řezáč, Jan & Pavel Hobza. (2006). On the Nature of DNA‐Duplex Stability. Chemistry - A European Journal. 13(10). 2983–2989. 26 indexed citations

Rankless uses publication and citation data sourced from OpenAlex, an open and comprehensive bibliographic database. While OpenAlex provides broad and valuable coverage of the global research landscape, it—like all bibliographic datasets—has inherent limitations. These include incomplete records, variations in author disambiguation, differences in journal indexing, and delays in data updates. As a result, some metrics and network relationships displayed in Rankless may not fully capture the entirety of a scholar's output or impact.

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