Gary Tresadern

4.5k total citations
98 papers, 2.9k citations indexed

About

Gary Tresadern is a scholar working on Molecular Biology, Computational Theory and Mathematics and Cellular and Molecular Neuroscience. According to data from OpenAlex, Gary Tresadern has authored 98 papers receiving a total of 2.9k indexed citations (citations by other indexed papers that have themselves been cited), including 77 papers in Molecular Biology, 40 papers in Computational Theory and Mathematics and 23 papers in Cellular and Molecular Neuroscience. Recurrent topics in Gary Tresadern's work include Computational Drug Discovery Methods (40 papers), Protein Structure and Dynamics (31 papers) and Receptor Mechanisms and Signaling (25 papers). Gary Tresadern is often cited by papers focused on Computational Drug Discovery Methods (40 papers), Protein Structure and Dynamics (31 papers) and Receptor Mechanisms and Signaling (25 papers). Gary Tresadern collaborates with scholars based in Belgium, United States and Spain. Gary Tresadern's co-authors include Laura Pérez‐Benito, Andrés A. Trabanco, Herman van Vlijmen, Vytautas Gapsys, Bert L. de Groot, Hilde Lavreysen, Ian H. Hillier, Dimitris K. Agrafiotis, Gregor J. Macdonald and Karina Martínez‐Mayorga and has published in prestigious journals such as Proceedings of the National Academy of Sciences, Journal of the American Chemical Society and Journal of Biological Chemistry.

In The Last Decade

Gary Tresadern

96 papers receiving 2.9k citations

Peers

Gary Tresadern
Comparison fields: 5 of 126
  • Molecular Biology 2.0k
  • Computational Theory and Mathematics 1.1k
  • Organic Chemistry 537
  • Materials Chemistry 512
  • Cellular and Molecular Neuroscience 422
Claudio N. Cavasotto United States
Vittorio Limongelli Italy
Jens Carlsson Sweden
Marco De Vivo Italy
Matteo Masetti Italy
Felice C. Lightstone United States
A. Geoffrey Skillman United States
Edgar Jacoby Switzerland
Flemming Steen Jørgensen Denmark
Paul S. Charifson United States
Claudio N. Cavasotto United States View profile →
Citations per field, relative to Gary Tresadern
Gary Tresadern · 1×
Citations per year, relative to Gary Tresadern
Gary Tresadern · 1×

Countries citing papers authored by Gary Tresadern

Since Specialization
Citations

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

Fields of papers citing papers by Gary Tresadern

Since Specialization
Physical SciencesHealth SciencesLife SciencesSocial Sciences

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

Co-authorship network of co-authors of Gary Tresadern

This figure shows the co-authorship network connecting the top 25 collaborators of Gary Tresadern. A scholar is included among the top collaborators of Gary Tresadern 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 Gary Tresadern. Gary Tresadern 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
# Title Journal Authors Indexed citations
1 Spatio-temporal learning from molecular dynamics simulations for protein–ligand binding affinity prediction Bioinformatics Samia Aci‐Sèche, José Carlos Gómez-Tamayo et al. 0
2 PromptSMILES: prompting for scaffold decoration and fragment linking in chemical language models Journal of Cheminformatics Morgan Thomas, Mazen Ahmad et al. 2
3 Structural basis for the oligomerization-facilitated NLRP3 activation Nature Communications Xiaodi Yu, Rosalie Matico et al. 25
4 The Impact of Data on Structure-Based Binding Affinity Predictions Using Deep Neural Networks International Journal of Molecular Sciences Samia Aci‐Sèche, José Carlos Gómez-Tamayo et al. 7
5 Selective inhibitors of the PSEN1–gamma-secretase complex Journal of Biological Chemistry Lutgarde Serneels, Rajeshwar Narlawar et al. 10
6 MELD-Bracket Ranks Binding Affinities of Diverse Sets of Ligands Journal of Chemical Information and Modeling J.C. Robertson, Sandeep Somani et al. 2
7 Collaborative Assessment of Molecular Geometries and Energies from the Open Force Field Journal of Chemical Information and Modeling Lorenzo D’Amore, David F. Hahn et al. 13
8 Mechanism of covalent binding of ibrutinib to Bruton's tyrosine kinase revealed by QM/MM calculations Chemical Science Gary Tresadern, Herman van Vlijmen et al. 34
9 A phenotypic high-content, high-throughput screen identifies inhibitors of NLRP3 inflammasome activation Scientific Reports Val Millar, Tryfon Zarganes‐Tzitzikas et al. 10
10 Scaffold Hopping to Imidazo[1,2-a]pyrazin-8-one Positive Allosteric Modulators of Metabotropic Glutamate 2 Receptor ACS Omega Ana Isabel de Lucas, Juan A. Vega et al. 2
11 A Brain-Penetrant and Bioavailable Pyrazolopiperazine BACE1 Inhibitor Elicits Sustained Reduction of Amyloid β In Vivo ACS Medicinal Chemistry Letters Aldo Peschiulli, Daniel Oehlrich et al. 7
12 [1,2,4]Triazolo[1,5-a]pyrimidine Phosphodiesterase 2A Inhibitors: Structure and Free-Energy Perturbation-Guided Exploration Journal of Medicinal Chemistry Gary Tresadern, Ingrid Velter et al. 18
13 Monte Carlo simulations using PELE to identify a protein–protein inhibitor binding site and pose RSC Advances Lucía Díaz, Gary Tresadern et al. 5
14 DeltaDelta neural networks for lead optimization of small molecule potency Chemical Science José Jiménez-Luna, Laura Pérez‐Benito et al. 48
15 Inhibition of the Alanine-Serine-Cysteine-1 Transporter by BMS-466442 ACS Chemical Neuroscience Iván R. Torrecillas, Ana Isabel de Lucas et al. 9
16 Evaluation of a Series of β-Secretase 1 Inhibitors Containing Novel Heteroaryl-Fused-Piperazine Amidine Warheads ACS Medicinal Chemistry Letters Daniel Oehlrich, Aldo Peschiulli et al. 26
17 Computationally Guided Identification of Allosteric Agonists of the Metabotropic Glutamate 7 Receptor ACS Chemical Neuroscience José M. Cid, Hilde Lavreysen et al. 5
18 Covalent Allosteric Probe for the Metabotropic Glutamate Receptor 2: Design, Synthesis, and Pharmacological Characterization Journal of Medicinal Chemistry Xuesong Wang, Luc Peeters et al. 21
19 Fragment Binding to β-Secretase 1 without Catalytic Aspartate Interactions Identified via Orthogonal Screening Approaches ACS Omega Frederik Rombouts, Richard Alexander et al. 13
20 Discovery and Kinetic Profiling of 7-Aryl-1,2,4-triazolo[4,3-a]pyridines: Positive Allosteric Modulators of the Metabotropic Glutamate Receptor 2 Journal of Medicinal Chemistry José M. Cid, Thea Mulder‐Krieger et al. 35

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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