World's Best Scientists 2026 revealed!
Adrian J. Mulholland

Adrian J. Mulholland

D-Index & Metrics

Chemistry

D-Index
75
Citations
17114
World Ranking
4533
National Ranking
263

Adrian J. Mulholland publication distribution in Chemistry in 2026

The chart shows the distribution of publications by all Research.com ranked scientists in the field of Chemistry in 2026. The highlighted bar marks where Adrian J. Mulholland sits on this spectrum.

61–80 publications: 66 scientists 81–100 publications: 302 scientists 101–120 publications: 623 scientists 121–140 publications: 918 scientists 141–160 publications: 1,218 scientists 161–180 publications: 1,350 scientists 181–200 publications: 1,344 scientists 201–220 publications: 1,281 scientists 221–240 publications: 1,216 scientists 241–260 publications: 1,100 scientists 261–280 publications: 979 scientists 281–300 publications: 939 scientists 301–320 publications: 764 scientists 321–340 publications: 643 scientists 341–360 publications: 628 scientists 361–380 publications: 522 scientists 381–400 publications: 459 scientists 401–420 publications: 397 scientists 421–440 publications: 327 scientists 441–460 publications: 270 scientists 461–480 publications: 265 scientists 481–500 publications: 252 scientists 501–520 publications: 201 scientists 521–540 publications: 185 scientists 541–560 publications: 148 scientists 561–580 publications: 148 scientists 581–600 publications: 132 scientists 601–620 publications: 114 scientists 621–640 publications: 104 scientists 641–660 publications: 91 scientists 661–680 publications: 92 scientists 681–700 publications: 73 scientists 701–720 publications: 57 scientists 721–740 publications: 54 scientists 741–760 publications: 67 scientists 761–780 publications: 45 scientists 781–800 publications: 46 scientists 801–820 publications: 39 scientists 821–840 publications: 32 scientists 841–860 publications: 36 scientists 861–880 publications: 29 scientists 881–900 publications: 26 scientists 901–920 publications: 24 scientists 921–940 publications: 14 scientists 941–960 publications: 23 scientists 961–980 publications: 28 scientists 981–1,000 publications: 15 scientists 1,001–1,020 publications: 29 scientists 1,021–1,040 publications: 12 scientists 1,041–1,060 publications: 19 scientists 1,061–1,080 publications: 12 scientists 1,081–1,100 publications: 6 scientists 1,101–1,120 publications: 8 scientists 1,121–1,140 publications: 12 scientists 1,141–1,160 publications: 5 scientists 1,161–1,180 publications: 6 scientists 1,181–1,200 publications: 14 scientists 1,201–1,220 publications: 7 scientists 1,221–1,240 publications: 2 scientists 1,241–1,260 publications: 6 scientists 1,261–1,280 publications: 4 scientists 1,281–1,294 publications: 6 scientists 1,295+ publications: 100 scientists
61 publications 1,295+

This scientist: 346 publications — 72nd percentile

72% of scientists in this discipline score the same or lower.

The last bar groups every scientist with 1,295 publications or more.

Adrian J. Mulholland D-index placement in Chemistry in 2026

The chart shows the D-index (discipline H-index) distribution of Chemistry scientists ranked by Research.com in 2026. The highlighted bar marks where Adrian J. Mulholland sits on this spectrum.

40–41 D-Index: 289 scientists 42–43 D-Index: 612 scientists 44–45 D-Index: 808 scientists 46–47 D-Index: 776 scientists 48–49 D-Index: 835 scientists 50–51 D-Index: 861 scientists 52–53 D-Index: 872 scientists 54–55 D-Index: 933 scientists 56–57 D-Index: 1,051 scientists 58–59 D-Index: 930 scientists 60–61 D-Index: 882 scientists 62–63 D-Index: 834 scientists 64–65 D-Index: 731 scientists 66–67 D-Index: 775 scientists 68–69 D-Index: 683 scientists 70–71 D-Index: 646 scientists 72–73 D-Index: 561 scientists 74–75 D-Index: 501 scientists 76–77 D-Index: 437 scientists 78–79 D-Index: 388 scientists 80–81 D-Index: 354 scientists 82–83 D-Index: 292 scientists 84–85 D-Index: 275 scientists 86–87 D-Index: 254 scientists 88–89 D-Index: 235 scientists 90–91 D-Index: 185 scientists 92–93 D-Index: 192 scientists 94–95 D-Index: 155 scientists 96–97 D-Index: 163 scientists 98–99 D-Index: 125 scientists 100–101 D-Index: 105 scientists 102–103 D-Index: 105 scientists 104–105 D-Index: 112 scientists 106–107 D-Index: 88 scientists 108–109 D-Index: 68 scientists 110–111 D-Index: 69 scientists 112–113 D-Index: 65 scientists 114–115 D-Index: 79 scientists 116–117 D-Index: 61 scientists 118–119 D-Index: 44 scientists 120–121 D-Index: 37 scientists 122–123 D-Index: 40 scientists 124–125 D-Index: 33 scientists 126–127 D-Index: 26 scientists 128–129 D-Index: 34 scientists 130–131 D-Index: 35 scientists 132–133 D-Index: 25 scientists 134–135 D-Index: 27 scientists 136–137 D-Index: 17 scientists 138–139 D-Index: 16 scientists 140–141 D-Index: 20 scientists 142–143 D-Index: 20 scientists 144–145 D-Index: 15 scientists 146–147 D-Index: 9 scientists 148–149 D-Index: 9 scientists 150–151 D-Index: 16 scientists 152–153 D-Index: 11 scientists 154–155 D-Index: 9 scientists 156–157 D-Index: 3 scientists 158 D-Index: 3 scientists 159+ D-Index: 98 scientists
40 D-Index 159+

This scientist: 75 D-Index — 76th percentile

76% of scientists in this discipline score the same or lower.

The last bar groups every scientist with 159 D-Index or more.

Overview

Adrian J. Mulholland is affiliated with the University of Bristol in the United Kingdom and specializes in the field of Biochemistry, Genetics and Molecular Biology. Their work largely focuses on Molecular Biology, Infectious Diseases, Molecular Medicine, Computational Theory and Mathematics, and Materials Chemistry.

Their research encompasses multiple main topics including Protein Structure and Dynamics, Antibiotic Resistance in Bacteria, SARS-CoV-2 and COVID-19 Research, Computational Drug Discovery Methods, Enzyme Catalysis and Immobilization, Enzyme Structure and Function, and Microbial Metabolic Engineering and Bioproduction.

Some of the recent papers authored or co-authored by Adrian J. Mulholland include:

  • Free fatty acid binding pocket in the locked structure of SARS-CoV-2 spike protein (2020, Science)
  • Temperature, Dynamics, and Enzyme-Catalyzed Reaction Rates (2020, Annual Review of Biophysics)
  • Mechanism of inhibition of SARS-CoV-2 M pro by N3 peptidyl Michael acceptor explained by QM/MM simulations and design of new derivatives with tunable chemical reactivity (2020, Chemical Science)
  • Evolution of dynamical networks enhances catalysis in a designer enzyme (2021, Nature Chemistry)
  • Constructing ion channels from water-soluble α-helical barrels (2021, Nature Chemistry)

Frequent co-authors collaborating with Mulholland include:

  • James Spencer
  • A. Sofia F. Oliveira
  • Marc W. van der Kamp
  • Christiane Schaffitzel
  • Imre Berger

The scientist's work has been published frequently in several venues, among them:

  • bioRxiv (Cold Spring Harbor Laboratory)
  • Journal of Chemical Information and Modeling
  • Faculty Opinions - Post-Publication Peer Review of the Biomedical Literature
  • ACS Catalysis
  • Chemical Science

In addition to journal articles, Mulholland has contributed to academic books, including a publication titled Modern Developments in Catalysis with WORLD SCIENTIFIC (EUROPE) eBooks in 2021.

Best Publications

  • Combined quantum mechanics/molecular mechanics (QM/MM) methods in computational enzymology

    Marc W van der Kamp;Adrian J Mulholland

  • Free fatty acid binding pocket in the locked structure of SARS-CoV-2 spike protein.

    Christine Toelzer;Kapil Gupta;Sathish K. N. Yadav;Ufuk Borucu

  • Atomic description of an enzyme reaction dominated by proton tunneling

    Laura Masgrau;Anna Roujeinikova;Linus O. Johannissen;Parvinder Hothi

  • High‐Accuracy Computation of Reaction Barriers in Enzymes

    Frederik Claeyssens;Jeremy N. Harvey;Frederick R. Manby;Ricardo A. Mata

  • On the Temperature Dependence of Enzyme-Catalyzed Rates

    Vickery L. Arcus;Erica J. Prentice;Joanne K. Hobbs;Adrian J. Mulholland

  • Taking Ockham's razor to enzyme dynamics and catalysis.

    David R. Glowacki;Jeremy N. Harvey;Adrian J. Mulholland

  • Does Compound I Vary Significantly between Isoforms of Cytochrome P450

    Richard Lonsdale;Julianna Oláh;Adrian J. Mulholland;Jeremy N. Harvey

  • Modelling enzyme reaction mechanisms, specificity and catalysis.

    Adrian J. Mulholland

  • Insights into Chorismate Mutase Catalysis from a Combined QM/MM Simulation of the Enzyme Reaction

    Paul D. Lyne;Adrian J. Mulholland;W. Graham Richards

  • A practical guide to modelling enzyme-catalysed reactions

    Richard Lonsdale;Jeremy N. Harvey;Adrian J. Mulholland

  • Electronic structure of compound I in human isoforms of cytochrome P450 from QM/MM modeling.

    Christine M. Bathelt;Jolanta Zurek;and Adrian J. Mulholland;Jeremy N. Harvey

  • Multiscale methods in drug design bridge chemical and biological complexity in the search for cures

    Rommie E Amaro;Adrian J Mulholland

  • Inclusion of Dispersion Effects Significantly Improves Accuracy of Calculated Reaction Barriers for Cytochrome P450 Catalyzed Reactions

    Richard Lonsdale;Jeremy N. Harvey;Adrian J. Mulholland

  • Biomolecular simulations: From dynamics and mechanisms to computational assays of biological activity

    David J. Huggins;David J. Huggins;Philip C. Biggin;Marc A. Dämgen;Jonathan W. Essex

  • Mechanisms of antibiotic resistance: QM/MM modeling of the acylation reaction of a class A beta-lactamase with benzylpenicillin.

    Johannes C Hermann;Christian Hensen;Lars Ridder;Adrian J Mulholland

  • The Catalytic Mechanism of a Natural Diels–Alderase Revealed in Molecular Detail

    Matthew J. Byrne;Nicholas R. Lees;Nicholas R. Lees;Li-Chen Han;Marc W. van der Kamp

  • Temperature, Dynamics, and Enzyme-Catalyzed Reaction Rates

    Vickery L Arcus;Adrian J Mulholland

  • Aromatic hydroxylation by cytochrome P450: model calculations of mechanism and substituent effects.

    Christine M. Bathelt;Lars Ridder;and Adrian J. Mulholland;Jeremy N. Harvey

  • P450-Catalyzed Regio- and Diastereoselective Steroid Hydroxylation: Efficient Directed Evolution Enabled by Mutability Landscaping

    Carlos G. Acevedo-Rocha;Carlos G. Acevedo-Rocha;Charles G. Gamble;Richard Lonsdale;Richard Lonsdale;Richard Lonsdale;Aitao Li;Aitao Li;Aitao Li

  • Quantum mechanics/molecular mechanics modeling of regioselectivity of drug metabolism in cytochrome P450 2C9.

    Richard Lonsdale;Kerensa T Houghton;Jolanta Żurek;Christine M Bathelt

  • Unraveling the role of protein dynamics in dihydrofolate reductase catalysis.

    Louis Y. P. Luk;J. Javier Ruiz-Pernía;William M. Dawson;Maite Roca

  • Differential transition-state stabilization in enzyme catalysis: quantum chemical analysis of interactions in the chorismate mutase reaction and prediction of the optimal catalytic field.

    Borys Szefczyk;Adrian J Mulholland;Kara E Ranaghan;W Andrzej Sokalski

  • Ab initio QM/MM study of the citrate synthase mechanism. A low-barrier hydrogen bond is not involved

    Adrian J. Mulholland;and Paul D. Lyne;Martin Karplus

Frequent Co-Authors

Richard B. Sessions
Richard B. Sessions University of Bristol
Marco Mor
Marco Mor University of Parma
Nigel S. Scrutton
Nigel S. Scrutton University of Manchester
Timothy Gallagher
Timothy Gallagher University of Bristol
Francesco Luigi Gervasio
Francesco Luigi Gervasio University College London
Ivonne M.C.M. Rietjens
Ivonne M.C.M. Rietjens Wageningen University & Research
Derek N. Woolfson
Derek N. Woolfson University of Bristol
Susan Wonnacott
Susan Wonnacott University of Bath
Frederik Claeyssens
Frederik Claeyssens University of Sheffield

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