S. Gražulis

6.9k total citations · 4 hit papers
80 papers, 4.8k citations indexed

About

S. Gražulis is a scholar working on Molecular Biology, Physical and Theoretical Chemistry and Materials Chemistry. According to data from OpenAlex, S. Gražulis has authored 80 papers receiving a total of 4.8k indexed citations (citations by other indexed papers that have themselves been cited), including 54 papers in Molecular Biology, 22 papers in Physical and Theoretical Chemistry and 22 papers in Materials Chemistry. Recurrent topics in S. Gražulis's work include Enzyme function and inhibition (28 papers), Synthesis and Catalytic Reactions (17 papers) and Chemical Reactions and Mechanisms (14 papers). S. Gražulis is often cited by papers focused on Enzyme function and inhibition (28 papers), Synthesis and Catalytic Reactions (17 papers) and Chemical Reactions and Mechanisms (14 papers). S. Gražulis collaborates with scholars based in Lithuania, Germany and Czechia. S. Gražulis's co-authors include Andrius Merkys, M. Quirós, Antanas Vaitkus, Daniel Chateigner, Luca Lutterotti, Peter Moeck, E. Manakova, A. Le Bail, Robert T. Downs and Alex Yokochi and has published in prestigious journals such as Proceedings of the National Academy of Sciences, Nucleic Acids Research and The EMBO Journal.

In The Last Decade

S. Gražulis

77 papers receiving 4.7k citations

Hit Papers

align trajectories

What are hit papers?

Hit papers significantly outperform the citation benchmark for their cohort. A paper qualifies if it has ≥500 total citations, achieves ≥1.5× the top-1% citation threshold for papers in the same subfield and year (this is the minimum needed to enter the top 1%, not the average within it), or reaches the top citation threshold in at least one of its specific research topics.

Crystallography Open Database – an open-access collection of crystal structures

2009 1.3k citations S. Gražulis, Daniel Chateigner et al. Journal of Applied Crystallography profile →
Crystallography Open Database (COD): an open-access collection of crystal structures and platform for world-wide collaboration

2011 918 citations S. Gražulis, Andrius Merkys et al. Nucleic Acids Research profile →
AceDRG: a stereochemical description generator for ligands

2017 261 citations S. Gražulis, Andrius Merkys et al. profile →
Validation of the Crystallography Open Database using the Crystallographic Information Framework

2021 252 citations Antanas Vaitkus, Andrius Merkys et al. Journal of Applied Crystallography profile →

Peers

Countries citing papers authored by S. Gražulis

Since Specialization

Citations

This map shows the geographic impact of S. Gražulis'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 S. Gražulis with the expected number of citations based on a country's size and research output (numbers larger than one mean the country cites S. Gražulis more than expected).

Fields of papers citing papers by S. Gražulis

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by S. Gražulis. 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 S. Gražulis. The network helps show where S. Gražulis may publish in the future.

Co-authorship network of co-authors of S. Gražulis

This figure shows the co-authorship network connecting the top 25 collaborators of S. Gražulis. A scholar is included among the top collaborators of S. Gražulis 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 S. Gražulis. S. Gražulis is excluded from the visualization to improve readability, since they are connected to all nodes in the network.

All Works

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20 of 20 papers shown

#	Work	Indexed citations
1	Design of Rigid Compounds to Enhance Selectivity for Carbonic Anhydrase IX 2025 ·Chemistry - A European Journal ·(unknown), (unknown), (unknown), E. Manakova, (unknown), (unknown), (unknown), (unknown), А. В. Смирнов, Lina Baranauskienė, S. Gražulis, Asta Zubrienė, Virginija Dudutienė, Daumantas Matulis	1
2	Affinity and Selectivity of Protein–Ligand Recognition: A Minor Chemical Modification Changes Carbonic Anhydrase Binding Profile 2025 ·Journal of Medicinal Chemistry ·(unknown), (unknown), (unknown), Edita Čapkauskaitė, (unknown), А. В. Смирнов, (unknown), Ja̅nis Leita̅ns, J. Brynda, Andris Kazāks, Lina Baranauskienė, E. Manakova, S. Gražulis, Visvaldas Kairys, Kaspars Tārs, Pavlína Řezáčová, Daumantas Matulis	0
3	From X-ray crystallographic structure to intrinsic thermodynamics of protein–ligand binding using carbonic anhydrase isozymes as a model system 2024 ·IUCrJ ·(unknown), А. В. Смирнов, E. Manakova, Lina Baranauskienė, Vytautas Petrauskas, Asta Zubrienė, Jurgita Matulienė, Virginija Dudutienė, Edita Čapkauskaitė, (unknown), Ja̅nis Leita̅ns, S. Gražulis, Kaspars Tārs, Daumantas Matulis	1
4	Graph isomorphism-based algorithm for cross-checking chemical and crystallographic descriptions 2023 ·Journal of Cheminformatics ·Andrius Merkys, Antanas Vaitkus, (unknown), (unknown), M. Quirós, S. Gražulis	53
5	A workflow for deriving chemical entities from crystallographic data and its application to the Crystallography Open Database 2023 ·Journal of Cheminformatics ·Antanas Vaitkus, Andrius Merkys, Thomas Sander, M. Quirós, Paul Thiessen, Evan Bolton, S. Gražulis	57
6	Methyl 2-Halo-4-Substituted-5-Sulfamoyl-Benzoates as High Affinity and Selective Inhibitors of Carbonic Anhydrase IX 2021 ·International Journal of Molecular Sciences ·(unknown), Edita Čapkauskaitė, (unknown), А. В. Смирнов, Ja̅nis Leita̅ns, Andris Kazāks, (unknown), (unknown), (unknown), Jelena Jachno, (unknown), Vaida Linkuvienė, Andrius Sakalauskas, E. Manakova, S. Gražulis, Jurgita Matulienė, Kaspars Tārs, Daumantas Matulis	12
7	The OPTIMADE Specification 2020 ·Zenodo (CERN European Organization for Nuclear Research) ·Casper Welzel Andersen, Rickard Armiento, Evgeny Blokhin, G. J. Conduit, Shyam Dwaraknath, Matthew L. Evans, (unknown), (unknown), S. Gražulis, Andrius Merkys, Fawzi Mohamed, Corey Oses, Giovanni Pizzi, Gian‐Marco Rignanese, Markus Scheidgen, Leopold Talirz, Cormac Toher, Donny Winston	2
8	Raman Open Database: first interconnected Raman–X-ray diffraction open-access resource for material identification 2019 ·Journal of Applied Crystallography ·Yassine El Mendili, Antanas Vaitkus, Andrius Merkys, S. Gražulis, Daniel Chateigner, (unknown), Stéphanie Gascoin, S. Petit, Jean‐François Bardeau, M. Zanatta, (unknown), G. Mariotto, Arun Kumar, (unknown), Luca Lutterotti, (unknown), Beate Orberger, P. Šimon, (unknown), (unknown)	38
9	Associations of vascular calcification, calcium phosphate disturbances, FGF 23 and Matrix Gla protein with mortality of hemodialysis patients: one center cohort study 2018 ·Revista română de medicină de laborator ·(unknown), (unknown), (unknown), Edita Žiginskienė, S. Gražulis, (unknown), (unknown), Inga Arūnė Bumblytė	2
10	Thermodynamic, kinetic, and structural parameterization of human carbonic anhydrase interactions toward enhanced inhibitor design 2018 ·Quarterly Reviews of Biophysics ·Vaida Linkuvienė, Asta Zubrienė, E. Manakova, Vytautas Petrauskas, Lina Baranauskienė, (unknown), А. В. Смирнов, S. Gražulis, John E. Ladbury, Daumantas Matulis	43
11	Intrinsic thermodynamics of high affinity inhibitor binding to recombinant human carbonic anhydrase IV 2017 ·European Biophysics Journal ·(unknown), David D. Timm, (unknown), Vaida Linkuvienė, Zhiwei Chen, Abdül Waheed, Vilma Michailovienė, Asta Zubrienė, А. В. Смирнов, Edita Čapkauskaitė, Lina Baranauskienė, Jelena Jachno, (unknown), E. Manakova, S. Gražulis, Jurgita Matulienė, Enrico Di, William S. Sly, Daumantas Matulis	13
12	Functionalization of Fluorinated Benzenesulfonamides and Their Inhibitory Properties toward Carbonic Anhydrases 2015 ·ChemMedChem ·Virginija Dudutienė, Asta Zubrienė, А. В. Смирнов, David D. Timm, Joana Smirnovienė, (unknown), Vilma Michailovienė, (unknown), E. Manakova, S. Gražulis, Daumantas Matulis	32
13	Launching the Theoretical Crystallography Open Database 2014 ·Acta Crystallographica Section A Foundations and Advances ·S. Gražulis, Andrius Merkys, Antanas Vaitkus, A. Le Bail, Daniel Chateigner, Linas Vilčiauskas, (unknown), Torbjörn Björkman, Peter Murray‐Rust	2
14	Crystal structure of the R-protein of the multisubunit ATP-dependent restriction endonuclease NgoAVII 2014 ·Nucleic Acids Research ·Giedrė Tamulaitienė, Arūnas Šilanskas, S. Gražulis, Mindaugas Zaremba, Virginijus Šikšnys	8
15	Design, Synthesis, Binding, Crystallography, and Docking of [(2-Pyrimidinylthio)Acetyl]Benzenesulfonamides as Inhibitors of Human Carbonic Anhydrases 2013 ·Biophysical Journal ·Daumantas Matulis, Edita Čapkauskaitė, Asta Zubrienė, Lina Baranauskienė, Giedrė Tamulaitienė, E. Manakova, Visvaldas Kairys, S. Gražulis, Sigitas Tumkevičius	1
16	4-Substituted-2,3,5,6-tetrafluorobenzenesulfonamides as inhibitors of carbonic anhydrases I, II, VII, XII, and XIII 2013 ·Bioorganic & Medicinal Chemistry ·Virginija Dudutienė, Asta Zubrienė, А. В. Смирнов, (unknown), David D. Timm, E. Manakova, S. Gražulis, Daumantas Matulis	61
17	Structure of the metal-independent restriction enzyme BfiI reveals fusion of a specific DNA-binding domain with a nonspecific nuclease 2005 ·Proceedings of the National Academy of Sciences ·S. Gražulis, E. Manakova, Manfred Roessle, Matthias Bochtler, Giedrė Tamulaitienė, Robert Huber, Virginijus Šikšnys	81
18	Crystallization and preliminary crystallographic studies of a bifunctional restriction endonuclease Eco57I 2004 ·Biochimica et Biophysica Acta (BBA) - Proteins and Proteomics ·Giedrė Tamulaitienė, S. Gražulis, A. Janulaitis, Robert Janowski, Grzegorz Bujacz, Mariusz Jaskólski	3
19	[Renal failure due to a villous adenoma]. 2003 ·Lithuanian University of Health Sciences ·(unknown), (unknown), (unknown), S. Gražulis	2
20	Structure-based redesign of the Catalytic/Metal binding site of Cfr 10I restriction endonuclease reveals importance of spatial rather than sequence conservation of active centre residues 1998 ·Journal of Molecular Biology ·(unknown), S. Gražulis, Damir Bozic, Robert Huber, (unknown)	43

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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