Hannah E. Bruce Macdonald

698 total citations
13 papers, 372 citations indexed

About

Hannah E. Bruce Macdonald is a scholar working on Molecular Biology, Computational Theory and Mathematics and Atomic and Molecular Physics, and Optics. According to data from OpenAlex, Hannah E. Bruce Macdonald has authored 13 papers receiving a total of 372 indexed citations (citations by other indexed papers that have themselves been cited), including 11 papers in Molecular Biology, 4 papers in Computational Theory and Mathematics and 3 papers in Atomic and Molecular Physics, and Optics. Recurrent topics in Hannah E. Bruce Macdonald's work include Protein Structure and Dynamics (9 papers), Computational Drug Discovery Methods (4 papers) and Spectroscopy and Quantum Chemical Studies (2 papers). Hannah E. Bruce Macdonald is often cited by papers focused on Protein Structure and Dynamics (9 papers), Computational Drug Discovery Methods (4 papers) and Spectroscopy and Quantum Chemical Studies (2 papers). Hannah E. Bruce Macdonald collaborates with scholars based in United Kingdom, United States and Belgium. Hannah E. Bruce Macdonald's co-authors include Jonathan W. Essex, Gregory A. Ross, Richard D. Taylor, John D. Chodera, Vytautas Gapsys, Hugues Bonnet, David F. Hahn, Laura Pérez‐Benito, Antonia S. J. S. Mey and Angéline Van der Heyden and has published in prestigious journals such as Chemical Society Reviews, Biochemistry and The Journal of Physical Chemistry C.

In The Last Decade

Hannah E. Bruce Macdonald

13 papers receiving 359 citations

Peers

Hannah E. Bruce Macdonald

CTM

GHP

SPECT

Katarzyna Bernacki United States

E. V. Katkova Russia

Steven Lettieri United States

V. Vishal United States

Koji Okuwaki Japan

Jessica A. Nash United States

Zhenyu Meng Singapore

Jochen Farwer United Kingdom

Hjc Berendsen Netherlands

Thomas Neusius Germany

Katarzyna Bernacki United States

Hannah E. Bruce Macdonald

265 ×1.1

148 ×1.5

CTM

93 ×0.9

9 ×0.2

GHP

38 ×0.7

SPECT

Citations per year, relative to Hannah E. Bruce Macdonald Hannah E. Bruce Macdonald (= 1×) peers Katarzyna Bernacki

Countries citing papers authored by Hannah E. Bruce Macdonald

Since Specialization

Citations

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

Fields of papers citing papers by Hannah E. Bruce Macdonald

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Hannah E. Bruce Macdonald. 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 Hannah E. Bruce Macdonald. The network helps show where Hannah E. Bruce Macdonald may publish in the future.

Co-authorship network of co-authors of Hannah E. Bruce Macdonald

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

All Works

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13 of 13 papers shown

Wang, Yuanqing, Josh Fass, Benjamin Kaminow, et al.. (2022). End-to-end differentiable construction of molecular mechanics force fields. Chemical Science. 13(41). 12016–12033. 46 indexed citations

Hahn, David F., Christopher I. Bayly, Melissa L. Boby, et al.. (2022). Best Practices for Constructing, Preparing, and Evaluating Protein-Ligand Binding Affinity Benchmarks [Article v1.0]. PubMed. 4(1). 1497–1497. 46 indexed citations

Macdonald, Hannah E. Bruce, et al.. (2022). Water Networks in Complexes between Proteins and FDA-Approved Drugs. Journal of Chemical Information and Modeling. 63(1). 387–396. 8 indexed citations

Taylor, Richard D., et al.. (2021). Water molecules at protein–drug interfaces: computational prediction and analysis methods. Chemical Society Reviews. 50(16). 9104–9120. 43 indexed citations

Thomaston, Jessica L., Chunlong Ma, Yanmei Hu, et al.. (2021). Rimantadine Binds to and Inhibits the Influenza A M2 Proton Channel without Enantiomeric Specificity. Biochemistry. 60(32). 2471–2482. 14 indexed citations

Macdonald, Hannah E. Bruce, et al.. (2020). grand: A Python Module for Grand Canonical Water Sampling in OpenMM. Journal of Chemical Information and Modeling. 60(10). 4436–4441. 25 indexed citations

Mey, Antonia S. J. S., Bryce K. Allen, Hannah E. Bruce Macdonald, et al.. (2019). Best Practices for Alchemical Free Energy Calculations [Article v1.0]. 2(1). 7 indexed citations

Macdonald, Hannah E. Bruce, Hugues Bonnet, Angéline Van der Heyden, et al.. (2019). Influence of Aptamer Surface Coverage on Small Target Recognition: A SPR and QCM-D Comparative Study. The Journal of Physical Chemistry C. 123(22). 13561–13568. 29 indexed citations

Macdonald, Hannah E. Bruce, et al.. (2018). Prediction of the Closed Conformation and Insights into the Mechanism of the Membrane Enzyme LpxR. Biophysical Journal. 115(8). 1445–1456. 3 indexed citations

10.

Macdonald, Hannah E. Bruce, et al.. (2018). Ligand Binding Free Energies with Adaptive Water Networks: Two-Dimensional Grand Canonical Alchemical Perturbations. Journal of Chemical Theory and Computation. 14(12). 6586–6597. 33 indexed citations

11.

Potticary, Jason, et al.. (2017). Polymorphism in crystals of bis(4-bromophenyl)fumaronitrile through vapour phase growth. CrystEngComm. 19(48). 7223–7228. 4 indexed citations

12.

Ross, Gregory A., et al.. (2017). Replica-Exchange and Standard State Binding Free Energies with Grand Canonical Monte Carlo. Journal of Chemical Theory and Computation. 13(12). 6373–6381. 42 indexed citations

13.

Macdonald, Hannah E. Bruce. (2007). Relational ethics and advocacy in nursing: literature review. Journal of Advanced Nursing. 57(2). 119–126. 72 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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