Stephen D. Roughley

4.5k total citations · 1 hit paper
18 papers, 3.0k citations indexed

About

Stephen D. Roughley is a scholar working on Molecular Biology, Computational Theory and Mathematics and Organic Chemistry. According to data from OpenAlex, Stephen D. Roughley has authored 18 papers receiving a total of 3.0k indexed citations (citations by other indexed papers that have themselves been cited), including 15 papers in Molecular Biology, 10 papers in Computational Theory and Mathematics and 7 papers in Organic Chemistry. Recurrent topics in Stephen D. Roughley's work include Computational Drug Discovery Methods (10 papers), Chemical Synthesis and Analysis (8 papers) and Asymmetric Synthesis and Catalysis (3 papers). Stephen D. Roughley is often cited by papers focused on Computational Drug Discovery Methods (10 papers), Chemical Synthesis and Analysis (8 papers) and Asymmetric Synthesis and Catalysis (3 papers). Stephen D. Roughley collaborates with scholars based in United Kingdom, Japan and United States. Stephen D. Roughley's co-authors include Allan M. Jordan, Roderick E. Hubbard, Paul A. Brough, Natalia Matassova, Xavier Barril, James B. Murray, Joseph P. Adams, Geoffrey M. Williams, Lisa Wright and Andrew J. Massey and has published in prestigious journals such as Journal of the American Chemical Society, Nature Chemistry and Journal of Medicinal Chemistry.

In The Last Decade

Stephen D. Roughley

18 papers receiving 2.9k 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.

The Medicinal Chemist’s Toolbox: An Analysis of Reactions Used in the Pursuit of Drug Candidates

2011 2.2k citations Stephen D. Roughley, Allan M. Jordan Journal of Medicinal Chemistry profile →

Peers — A (Enhanced Table)

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

Name	h						Papers	Cites
Stephen D. Roughley United Kingdom	13	2.2k	1.1k	487	388	198	18	3.0k
Anthony G. Coyne United Kingdom	22	1.7k 0.8×	1.1k 0.9×	270 0.6×	225 0.6×	181 0.9×	62	2.7k
Guido Koch Switzerland	25	1.4k 0.6×	573 0.5×	438 0.9×	132 0.3×	284 1.4×	54	1.9k
Richard Lonsdale Germany	28	780 0.4×	1.6k 1.4×	555 1.1×	265 0.7×	189 1.0×	39	2.6k
Rodolfo Lavilla Spain	31	3.2k 1.4×	1.3k 1.2×	232 0.5×	219 0.6×	186 0.9×	109	4.0k
Andrey A. Tolmachev Ukraine	25	2.0k 0.9×	935 0.8×	207 0.4×	441 1.1×	67 0.3×	204	2.8k
David C. Blakemore United Kingdom	31	3.8k 1.7×	755 0.7×	577 1.2×	113 0.3×	277 1.4×	87	4.6k
Kiyosei Takasu Japan	32	3.2k 1.4×	841 0.7×	611 1.3×	105 0.3×	73 0.4×	169	3.7k
S. B. Jennifer Kan United States	21	1.4k 0.6×	1.1k 0.9×	362 0.7×	57 0.1×	212 1.1×	30	2.3k
Louis‐Charles Campeau United States	28	4.8k 2.2×	763 0.7×	795 1.6×	207 0.5×	433 2.2×	59	5.8k
Binh Khanh United States	26	1.0k 0.5×	593 0.5×	464 1.0×	153 0.4×	59 0.3×	89	1.9k

Countries citing papers authored by Stephen D. Roughley

Since Specialization

Citations

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

Fields of papers citing papers by Stephen D. Roughley

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Stephen D. Roughley. 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 Stephen D. Roughley. The network helps show where Stephen D. Roughley may publish in the future.

Co-authorship network of co-authors of Stephen D. Roughley

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

All Works

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18 of 18 papers shown

Sánchez-García, Rubén, Tim Dudgeon, Stephen D. Roughley, et al.. (2023). Fragment Merging Using a Graph Database Samples Different Catalogue Space than Similarity Search. Journal of Chemical Information and Modeling. 63(11). 3423–3437. 10 indexed citations

Jones, Simon, James D. Firth, Masakazu Atobe, et al.. (2022). Exploration of piperidine 3D fragment chemical space: synthesis and 3D shape analysis of fragments derived from 20 regio- and diastereoisomers of methyl substituted pipecolinates. RSC Medicinal Chemistry. 13(12). 1614–1620. 4 indexed citations

Baker, Lisa, A. Aimon, James B. Murray, et al.. (2020). Rapid optimisation of fragments and hits to lead compounds from screening of crude reaction mixtures. Communications Chemistry. 3(1). 122–122. 12 indexed citations

Downes, Thomas D., Simon Jones, Hanna F. Klein, et al.. (2020). Design and Synthesis of 56 Shape‐Diverse 3D Fragments. Chemistry - A European Journal. 26(41). 8969–8975. 39 indexed citations

Roughley, Stephen D.. (2018). Five Years of the KNIME Vernalis Cheminformatics Community Contribution. Current Medicinal Chemistry. 27(38). 6495–6522. 15 indexed citations

Ruiz‐Carmona, Sergio, Peter Schmidtke, F. Javier Luque, et al.. (2016). Dynamic undocking and the quasi-bound state as tools for drug discovery. Nature Chemistry. 9(3). 201–206. 70 indexed citations

Murray, James B., Stephen D. Roughley, Natalia Matassova, & Paul A. Brough. (2014). Off-Rate Screening (ORS) By Surface Plasmon Resonance. An Efficient Method to Kinetically Sample Hit to Lead Chemical Space from Unpurified Reaction Products. Journal of Medicinal Chemistry. 57(7). 2845–2850. 46 indexed citations

Adams, Joseph P., Andrew D. Bond, Andrew B. Holmes, et al.. (2012). Intramolecular nitrone dipolar cycloadditions: control of regioselectivity and synthesis of naturally-occurring spirocyclic alkaloids. Organic & Biomolecular Chemistry. 10(45). 8963–8963. 11 indexed citations

Roughley, Stephen D., Lisa Wright, Paul A. Brough, Andrew J. Massey, & Roderick E. Hubbard. (2011). Hsp90 Inhibitors and Drugs from Fragment and Virtual Screening. Topics in current chemistry. 317. 61–82. 21 indexed citations

10.

Roughley, Stephen D. & Allan M. Jordan. (2011). The Medicinal Chemist’s Toolbox: An Analysis of Reactions Used in the Pursuit of Drug Candidates. Journal of Medicinal Chemistry. 54(10). 3451–3479. 2224 indexed citations breakdown →

11.

Roughley, Stephen D. & Roderick E. Hubbard. (2011). How Well Can Fragments Explore Accessed Chemical Space? A Case Study from Heat Shock Protein 90. Journal of Medicinal Chemistry. 54(12). 3989–4005. 58 indexed citations

12.

Roughley, Stephen D. & T. W. HART. (2010). Fatty acid amide hydrolase inhibitors. 2. Novel synthesis of sterically hindered azabenzhydryl ethers and an improved synthesis of VER-156084. Tetrahedron Letters. 51(39). 5191–5194. 2 indexed citations

13.

Jordan, Allan M. & Stephen D. Roughley. (2009). Drug discovery chemistry: a primer for the non-specialist. Drug Discovery Today. 14(15-16). 731–744. 35 indexed citations

14.

Dymock, Brian, Xavier Barril, Paul A. Brough, et al.. (2005). Novel, Potent Small-Molecule Inhibitors of the Molecular Chaperone Hsp90 Discovered through Structure-Based Design. Journal of Medicinal Chemistry. 48(13). 4212–4215. 177 indexed citations

15.

Baurin, Nicolas, C. E. Richardson, I‐Jen Chen, et al.. (2004). Drug-like Annotation and Duplicate Analysis of a 23-Supplier Chemical Database Totalling 2.7 Million Compounds. Journal of Chemical Information and Computer Sciences. 44(2). 643–651. 90 indexed citations

16.

Bower, Justin, Martin J. Drysdale, Allan M. Jordan, et al.. (2003). Structure-based design of agents targeting the bacterial ribosome. Bioorganic & Medicinal Chemistry Letters. 13(15). 2455–2458. 27 indexed citations

17.

Fox, Martin E., Andrew B. Holmes, Stephen D. Roughley, et al.. (2002). Nitrone dipolar cycloaddition routes to piperidines and indolizidines. Part 9.Part 8. See Ref. 22. Formal synthesis of (–)-pinidine and total synthesis of (–)-histrionicotoxin, (+)-histrionicotoxin and (–)-histrionicotoxin 235AThis manuscript is dedicated to the sixtieth birthday of Professor L. Tietze.. Journal of the Chemical Society Perkin Transactions 1. 1494–1514. 44 indexed citations

18.

Williams, Geoffrey M., Stephen D. Roughley, John E. Davies, Andrew B. Holmes, & Joseph P. Adams. (1999). Synthesis of (−)-Histrionicotoxin by a Tandem Process. Journal of the American Chemical Society. 121(20). 4900–4901. 74 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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