World's Best Scientists 2026 revealed!

D-Index & Metrics

Chemistry

D-Index
53
Citations
14397
World Ranking
12915
National Ranking
726

Overview

Nick Quirke is affiliated with Imperial College London in the United Kingdom. Their research spans several interdisciplinary fields, primarily focusing on computational and materials chemistry as well as toxicological studies related to nanomaterials.

Their recent publications cover a variety of topics and have appeared in recognized scientific venues. Key papers include:

  • Size dependency of gold nanoparticles interacting with model membranes, 2020, Communications Chemistry
  • Prediction of Chronic Inflammation for Inhaled Particles: the Impact of Material Cycling and Quarantining in the Lung Epithelium, 2020, Advanced Materials
  • First principles characterisation of bio-nano interface, 2021, Physical Chemistry Chemical Physics
  • From the Roundabout of Molecular Events to Nanomaterial-Induced Chronic Inflammation Prediction, 2020, bioRxiv (Cold Spring Harbor Laboratory)
  • Advanced in silico characterization of nanomaterials for nanoparticle toxicology, 2020, arXiv (Cornell University)

The scientist frequently collaborates with a group of co-authors, which notably includes M. Schneemilch, Vladimir Lobaskin, Alexander P. Lyubartsev, Claudia Contini, and Boštjan Kokot. These collaborations indicate ongoing partnerships in research efforts related to nanomaterials and their biological interactions.

Nick Quirke's work has been published in journals and archives such as Advanced Materials, arXiv (Cornell University), Molecular Simulation, Communications Chemistry, and Physical Chemistry Chemical Physics, reflecting interdisciplinary approaches within computational theory, toxicology, and chemistry.

Their research fields and subfields are diverse, encompassing:

  • Computational Theory and Mathematics
  • Health, Toxicology and Mutagenesis
  • Materials Chemistry
  • Biomaterials
  • Molecular Biology

The main scientific topics addressed include:

  • Computational Drug Discovery Methods
  • Air Quality and Health Impacts
  • Nanoparticles: synthesis and applications
  • Lipid Membrane Structure and Behavior
  • Electrochemical Analysis and Applications
  • Inhalation and Respiratory Drug Delivery
  • Iron oxide chemistry and applications

Best Publications

  • Phase equilibria by simulation in the Gibbs ensemble

    A.Z. Panagiotopoulos;N. Quirke;M. Stapleton;D.J. Tildesley

  • Pore size distribution analysis of microporous carbons: a density functional theory approach

    Christian Lastoskie;Keith E. Gubbins;Nicholas Quirke;Nicholas Quirke

  • A new analysis method for the determination of the pore size distribution of porous carbons from nitrogen adsorption measurements

    N.A. Seaton;J.P.R.B. Walton;N. quirke

  • Fluid flow in carbon nanotubes and nanopipes.

    M. Whitby;N. Quirke

  • Molecular modeling of electron traps in polymer insulators: Chemical defects and impurities

    M. Meunier;N. Quirke;A. Aslanides

  • Pore size heterogeneity and the carbon slit pore: a density functional theory model

    Christian Lastoskie;Keith E. Gubbins;Nicholas Quirke

  • Enhanced Fluid Flow through Nanoscale Carbon Pipes

    Max Whitby;Laurent Cagnon;Maya Thanou;Nick Quirke

  • FLUID FLOW IN NANOPORES: ACCURATE BOUNDARY CONDITIONS FOR CARBON NANOTUBES

    Vladimir P. Sokhan;David Nicholson;Nicholas Quirke

  • Molecular modeling of electron trapping in polymer insulators

    M. Meunier;N. Quirke

  • Molecular simulation of methane and butane in silicalite

    Susan J. Goodbody;Kyoko Watanabe;David MacGowan;Jeremy P. R. B. Walton

  • Rapid imbibition of fluids in carbon nanotubes.

    S. Supple;N. Quirke

  • Attractive Interactions in Micelles and Microemulsions

    J. S. Huang;S. A. Safran;M. W. Kim;G. S. Grest

  • Direct Molecular Dynamics Simulation of Flow Down a Chemical Potential Gradient in a Slit-Shaped Micropore

    Roger F. Cracknell;David Nicholson;Nicholas Quirke

  • Fluid flow in nanopores: An examination of hydrodynamic boundary conditions

    V. P. Sokhan;D. Nicholson;N. Quirke

  • Methane adsorption on microporous carbons—A comparison of experiment, theory, and simulation

    P.N. Aukett;N. Quirke;S. Riddiford;S.R. Tennison

  • Structure and Collapse of Particle Monolayers under Lateral Pressure at the Octane/Aqueous Surfactant Solution Interface†

    Robert Aveyard;John H. Clint;and Dieter Nees;Nick Quirke

  • Capillary Condensation: A Molecular Simulation Study

    J. P. R. B. Walton;N. Quirke

  • Nanoparticle–membrane interactions

    Claudia Contini;Matthew Schneemilch;Simon Gaisford;Nick Quirke

  • Computer simulation of molecular liquid mixtures. I. A diatomic Lennard‐Jones model mixture for CO2/C2H6

    D. Fincham;N. Quirke;D. J. Tildesley

  • Non-destructive molecular-dynamics simulation of the chemical potential of a fluid

    J.G. Powles;W.A.B. Evans;N. Quirke

Frequent Co-Authors

Keith E. Gubbins
Keith E. Gubbins North Carolina State University
David Nicholson
David Nicholson University of Queensland
Alexander P. Lyubartsev
Alexander P. Lyubartsev Stockholm University
Fernando Bresme
Fernando Bresme Imperial College London
Roger Cracknell
Roger Cracknell Shell (Netherlands)
Ulla Vogel
Ulla Vogel Technical University of Denmark
Martin Irmler
Martin Irmler University of Lausanne
Olivier Joubert
Olivier Joubert University of Nantes
Johannes Beckers
Johannes Beckers Technical University of Munich
Kwong-Yu Chan
Kwong-Yu Chan University of Hong Kong

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