P. Mulheran

发表

P. Mulheran, 1993 .

Towards an objective method to compare energy storage technologies: development and validation of a model to determine the upper boundary of revenue available from electrical price arbitrage

P. Mulheran, E. Barbour, I. Wilson, 2012 .

Thinking outside the Laboratory: Analyses of Antibody Structure and Dynamics within Different Solvent Environments in Molecular Dynamics (MD) Simulations

P. Mulheran, Mohammed M. Al Qaraghuli, K. Kubiak-Ossowska, 2018, Antibodies.

Antibody-protein binding and conformational changes: identifying allosteric signalling pathways to engineer a better effector response

P. Mulheran, V. Ferro, Mohammed M. Al Qaraghuli, 2020, Scientific Reports.

Aggregation of model asphaltenes: a molecular dynamics study

Z. J. Zhang, P. Mulheran, Zhenyu Zhang, 2016, Journal of physics. Condensed matter : an Institute of Physics journal.

Protein interactions with negatively charged inorganic surfaces: simulation and experiment

P. Mulheran, K. Kubiak-Ossowska, B. Jachimska, 2019 .

New insights on growth mechanisms of protein clusters at surfaces: an AFM and simulation study.

R. J. Green, P. Mulheran, M. Sperrin, 2008, Langmuir : the ACS journal of surfaces and colloids.

Molecular dynamics simulations of hen egg white lysozyme adsorption at a charged solid surface.

P. Mulheran, K. Kubiak, 2009, The journal of physical chemistry. B.

Conundrum of γ glycine nucleation revisited: to stir or not to stir?

P. Mulheran, K. Johnston, J. Sefcik, 2019, CrystEngComm.

Probing fibronectin adsorption on chemically defined surfaces by means of single molecule force microscopy

R. Tampé, P. Mulheran, R. Black, 2020, Scientific Reports.

Adsorption of Fibronectin Fragment on Surfaces Using Fully Atomistic Molecular Dynamics Simulations

P. Mulheran, R. Black, O. Thomas, 2018, International journal of molecular sciences.

An investigation into the links between island patterns and the mechanisms of thin film deposition

P. Mulheran, D. Robbie, 2000 .

Characterising submonolayer deposition via visibility graphs

P. Mulheran, M. Grinfeld, D. Allen, 2018, Physica A: Statistical Mechanics and its Applications.

On the statistical properties of the two-dimensional random voronoi network

P. Mulheran, 1992 .

Functionalisation of Inorganic Material Surfaces with Staphylococcus Protein A: A Molecular Dynamics Study

P. Mulheran, V. Ferro, Mohammed M. Al Qaraghuli, 2022, International journal of molecular sciences.

The Role of Antibodies in the Treatment of SARS-CoV-2 Virus Infection, and Evaluating Their Contribution to Antibody-Dependent Enhancement of Infection

P. Mulheran, V. Ferro, Mohammed M. Al Qaraghuli, 2022, International journal of molecular sciences.

Size-dependent mobility of gold nano-clusters during growth on chemically modified graphene

P. Mulheran, P. Pandey, N. Wilson, 2014 .

Understanding API Static Drying with Hot Gas Flow: Design and Test of a Drying Rig Prototype and Drying Modeling Development

P. Mulheran, C. Price, P. Firth, 2020, Organic process research & development.

Mechanisms and dynamics of protein clustering on a solid surface.

R. J. Green, P. Mulheran, M. Sperrin, 2008, Physical review letters.

Advancing Computational Analysis of Porous Materials—Modeling Three-Dimensional Gas Adsorption in Organic Gels

P. Mulheran, A. Fletcher, Martin Prostredný, 2021, The journal of physical chemistry. B.

A simple statistical model for grain growth in materials

P. Mulheran, J. Harding, 1991 .

Locating the nucleation sites for protein encapsulated gold nanoclusters: a molecular dynamics and fluorescence study.

P. Mulheran, D. Birch, K. Kubiak-Ossowska, 2015, Physical chemistry chemical physics : PCCP.

Seed induced growth of binary Ag/Au nanostructures on a graphite surface

P. Mulheran, R. Palmer, N. Lidgi-Guigui, 2008 .

Fibronectin module FN(III)9 adsorption at contrasting solid model surfaces studied by atomistic molecular dynamics.

P. Mulheran, W. Nowak, K. Kubiak-Ossowska, 2014, The journal of physical chemistry. B.

Probing the Sudlow binding site with warfarin: how does gold nanocluster growth alter human serum albumin?

P. Mulheran, D. Birch, Y. Chen, 2016, Physical chemistry chemical physics : PCCP.

Simulation of reconstructions of the polar ZnO(0001) surfaces

P. Mulheran, H. Meskine, 2010, 1006.1826.

Protein interactions with negatively charged inorganic surfaces

P. Mulheran, K. Kubiak-Ossowska, B. Jachimska, 2019, Current Opinion in Colloid & Interface Science.

Energy Landscape of Negatively Charged BSA Adsorbed on a Negatively Charged Silica Surface.

P. Mulheran, K. Kubiak-Ossowska, B. Jachimska, 2018, The journal of physical chemistry. B.

Bovine Serum Albumin Adsorption at a Silica Surface Explored by Simulation and Experiment.

P. Mulheran, K. Kubiak-Ossowska, B. Jachimska, 2017, The journal of physical chemistry. B.

Human serum albumin encapsulated gold nanoclusters: effects of cluster synthesis on natural protein characteristics.

P. Mulheran, B. Jachimska, Y. Chen, 2016, Journal of materials chemistry. B.

Chitin and Chitosan Binding to the α-Chitin Crystal: A Molecular Dynamics Study

P. Mulheran, K. Kubiak-Ossowska, V. Ferro, 2023, ACS omega.

Subgroup analyses in randomised controlled trials: quantifying the risks of false-positives and false-negatives.

T. Peters, P. Mulheran, G. Davey Smith, 2001, Health technology assessment.

Interfacial Concentration Effect Facilitates Heterogeneous Nucleation from Solution

P. Mulheran, K. Johnston, J. Sefcik, 2020, The journal of physical chemistry letters.

Tuning Interfacial Concentration Enhancement through Dispersion Interactions to Facilitate Heterogeneous Nucleation

P. Mulheran, K. Johnston, J. Sefcik, 2022, The journal of physical chemistry. C, Nanomaterials and interfaces.

TiO2 nanocluster modified-rutile TiO2 photocatalyst: a first principles investigation

P. Mulheran, M. Nolan, Anna Iwaszuk, 2013 .

Structural Analysis of Anti-Hapten Antibodies to Identify Long-Range Structural Movements Induced by Hapten Binding

P. Mulheran, V. Ferro, Mohammed M. Al Qaraghuli, 2021, Frontiers in Molecular Biosciences.

Biomolecular interactions with nanoparticles: applications for coronavirus disease 2019

P. Mulheran, V. Ferro, Mohammed M. Al Qaraghuli, 2021, Current Opinion in Colloid & Interface Science.

Subgroup analyses in randomized trials: risks of subgroup-specific analyses; power and sample size for the interaction test.

Sara T Brookes, Matthias Egger, Tim J Peters, 2004, Journal of clinical epidemiology.

Psychiatric Disorder as a Risk Factor for Cancer: Different Analytic Strategies Produce Different Findings

F. Rasmussen, P. Mulheran, P. Tynelius, 2012, Epidemiology.

Clustering behaviour of polyaromatic compounds mimicking natural asphaltenes

P. Mulheran, Z. Zhang, J. Sefcik, 2020 .

Mechanism of hen egg white lysozyme adsorption on a charged solid surface.

P. Mulheran, K. Kubiak-Ossowska, Karina Kubiak-Ossowska, 2010, Langmuir : the ACS journal of surfaces and colloids.

Reabsorption effect and spatial ordering in island ripening.

P. Mulheran, D. Tarr, 2003, Physical review. E, Statistical, nonlinear, and soft matter physics.

Chapter 4 Theory of Cluster Growth on Surfaces

P. Mulheran, 2008 .

Distributional fixed-point equations for island nucleation in one dimension: The inverse problem

P. Mulheran, M. Grinfeld, Hrvojka Krčelić, 2018, Physical Review E.

Distributional fixed-point equations for island nucleation in one dimension: a retrospective approach for capture-zone scaling.

P. Mulheran, M. Grinfeld, W. Lamb, 2012, Physical review. E, Statistical, nonlinear, and soft matter physics.

Capture-zone distribution in one-dimensional sub-monolayer film growth: a fragmentation theory approach

P. Mulheran, M. Grinfeld, W. Lamb, 2011, 1107.2805.

Kinetic phase diagram for island nucleation and growth during homoepitaxy

P. Mulheran, M. Basham, 2008 .

Multiscale modeling of island nucleation and growth during cu(100) homoepitaxy

P. Mulheran, M. Basham, F. Montalenti, 2006 .

Island Statistics Reflecting Growth Processes

P. Mulheran, 2002 .

Growth of clusters on surfaces: Monte Carlo simulations and scaling properties

P. A. Mulheran, P. Mulheran, J. Blackman, 2001 .

Impact of monomer evaporation on the statistics of island arrays formed in thin film deposition simulations

P. Mulheran, D. Robbie, 2000 .

Simulation and growth of gold on silicon oxide in one-dimensional and quasi-one-dimensional arrays

P. Mulheran, C. Vieu, M. Boero, 2000 .

Theory of the island and capture zone size distributions in thin film growth

P. Mulheran, D. Robbie, 2000 .

Simulation and theory of island growth on substrate steps

P. Mulheran, J. Blackman, 1997 .

Scaling behaviour in submonolayer film growth — Beyond mean field theory

P. Mulheran, J. Blackman, 1996 .

Theory of spatial and size scaling in strain-free island ripening

P. Mulheran, 2005 .

Mean field simulations of normal grain growth

P. Mulheran, 1992 .

A Statistical Theory of Normal Grain Growth

P. Mulheran, J. Harding, 1992 .

Surface and interstitial Ti diffusion at the rutile TiO(2)(110) surface.

P. Mulheran, E. Sanville, M. Nolan, 2010, Physical chemistry chemical physics : PCCP.

Non-stoichiometric oxide and metal interfaces and reactions

P. Mulheran, M. Nolan, M. Basham, 2009 .

Electronic structure of point defects in controlled self-doping of the TiO2 (110) surface: Combined photoemission spectroscopy and density functional theory study

P. Mulheran, M. Nolan, M. Basham, 2008 .

ORIGIN OF YIELD PROBLEMS OF SINGLE ELECTRON DEVICES BASED ON EVAPORATED GRANULAR FILMS

H. Mizuta, P. Mulheran, M. Boero, 1999 .

The stability of SnO2 surfaces

P. Mulheran, J. Harding, 1992 .

Critical role of tyrosine-20 in formation of gold nanoclusters within lysozyme: a molecular dynamics study.

P. Mulheran, K. Kubiak-Ossowska, Yu Chen, 2019, Physical chemistry chemical physics : PCCP.

Lysozyme encapsulated gold nanoclusters: effects of cluster synthesis on natural protein characteristics.

P. Mulheran, B. Jachimska, Y. Chen, 2017, Physical chemistry chemical physics : PCCP.

The scaling state in two-dimensional grain growth

P. Mulheran, 1994 .

Diffusion and stability of small vacancy clusters on Cu(1 0 0)––a simulation study

P. Mulheran, M. Basham, F. Montalenti, 2004 .

Island mobility and dynamic scaling during thin film deposition

P. Mulheran, D. Robbie, 2001 .

Modelling Organic Gel Growth in Three Dimensions: Textural and Fractal Properties of Resorcinol–Formaldehyde Gels

P. Mulheran, A. Fletcher, Martin Prostredný, 2020, Gels.

Modelling the formation of porous organic gels – how structural properties depend on growth conditions

P. Mulheran, A. Fletcher, Martin Prostredný, 2019, RSC advances.

Process Variable Optimization in the Manufacture of Resorcinol–Formaldehyde Gel Materials

P. Mulheran, A. Fletcher, Martin Prostredný, 2018, Gels.

Theory of self-organisation in sorted stone stripes

P. Mulheran, 1994 .

Modelling multi-scale material growth and erosion under energetic atomic deposition

P. Mulheran, Andrew M. Bell, 2022, Molecular Simulation.

Transition metal clusters on graphite

P. Mulheran, J. Blackman, D. Duffy, 1998 .

Rationalising drug delivery using nanoparticles: a combined simulation and immunology study of GnRH adsorbed to silica nanoparticles

P. Mulheran, V. Ferro, K. Kubiak-Ossowska, 2018, Scientific Reports.

Simulating Peptide Monolayer Formation: GnRH-I on Silica

P. Mulheran, V. Ferro, K. Kubiak-Ossowska, 2021, International journal of molecular sciences.

How Negatively Charged Proteins Adsorb to Negatively Charged Surfaces: A Molecular Dynamics Study of BSA Adsorption on Silica.

P. Mulheran, K. Kubiak-Ossowska, B. Jachimska, 2016, The journal of physical chemistry. B.

Steering protein adsorption at charged surfaces: electric fields and ionic screening

P. Mulheran, K. Kubiak-Ossowska, D. Connell, 2016 .

Lysozyme adsorption at a silica surface using simulation and experiment: effects of pH on protein layer structure.

P. Mulheran, K. Kubiak-Ossowska, B. Jachimska, 2015, Physical chemistry chemical physics : PCCP.

Spontaneous Membrane-Translocating Peptide Adsorption at Silica Surfaces: A Molecular Dynamics Study

Siddharth V. Patwardhan, P. Mulheran, K. Kubiak-Ossowska, 2013, The journal of physical chemistry. B.

What Governs Protein Adsorption and Immobilization at a Charged Solid Surface?

Paul A. Mulheran, P. Mulheran, K. Kubiak-Ossowska, 2010, Langmuir : the ACS journal of surfaces and colloids.

Multiprotein Interactions during Surface Adsorption: a Molecular Dynamics Study of Lysozyme Aggregation at a Charged Solid Surface

P. Mulheran, K. Kubiak-Ossowska, Karina Kubiak-Ossowska, 2011, The journal of physical chemistry. B.

The origins of island size scaling in heterogeneous film growth

P. Mulheran, J. Blackman, 1995 .

Asymptotics of capture zone distributions in a fragmentation-based model of submonolayer deposition

P. Mulheran, J. Blackman, M. Grinfeld, 2015 .

Gap-size and capture-zone distributions in one-dimensional point-island nucleation and growth simulations: asymptotics and models.

P. Mulheran, M. Grinfeld, W. Lamb, 2011, Physical review. E, Statistical, nonlinear, and soft matter physics.

Direct Immobilization of Engineered Nanobodies on Gold Sensors

P. Adriaensens, S. Muyldermans, M. Alexander, 2021, ACS applied materials & interfaces.

Recent Advances in Photothermal Therapies Against Cancer and the Role of Membrane Transporter Modulators on the Efficacy of This Approach

P. Mulheran, Mohammad A. Obeid, Mohammed M. Al Qaraghuli, 2023, Technology in cancer research & treatment.

Multiple myeloma: therapeutic delivery of antibodies and aptamers.

P. Mulheran, V. Ferro, Mohammed M. Al Qaraghuli, 2021, Therapeutic delivery.

Scaling of Glycine Nucleation Kinetics with Shear Rate and Glass–Liquid Interfacial Area

P. Mulheran, J. Sefcik, I. Burns, 2016 .

The dynamics of island nucleation and growth—beyond mean-field theory

P. Mulheran, 2004 .

Protein adsorption mechanisms on solid surfaces: lysozyme-on-mica

P. Mulheran, K. Kubiak, 2009 .

Protein diffusion and long-term adsorption states at charged solid surfaces.

P. Mulheran, K. Kubiak-Ossowska, Karina Kubiak-Ossowska, 2012, Langmuir : the ACS journal of surfaces and colloids.

Tyrosine Rotamer States in Beta Amyloid: Signatures of Aggregation and Fibrillation

P. Mulheran, O. Rolinski, K. Kubiak-Ossowska, 2018, ACS omega.

Influence of controlled fluid shear on nucleation rates in glycine aqueous solutions

P. Mulheran, M. Haw, J. Sefcik, 2015 .

SIMULATION AND THEORY OF ISLAND NUCLEATION, GROWTH, AND COALESCENCE ON STEPPED SUBSTRATES

P. Mulheran, C. Pownall, 1999 .

Simulations of growing ordered arrays of islands on substrate steps

P. Mulheran, C. Pownall, 2001 .

Modeling the deposition process of thermal barrier coatings

Maurizio Marchese, Gianni Jacucci, P. A. Mulheran, 1995 .

Filler-induced heterogeneous nucleation of polymer crystals investigated by molecular dynamics simulations

P. Mulheran, K. Johnston, Dominic Wadkin-Snaith, 2023, Polymer.

Monte Carlo simulation of the growth of metallic quantum dots

P. Mulheran, M. Boero, J. C. Inkson, 1998 .

Polyhydroxybutyrate: a review of experimental and simulation studies on the effect of fillers on crystallinity and mechanical properties

P. Mulheran, K. Johnston, J. Liggat, 2022, Polymer International.

Adatoms and interstitials in the rutile TiO2 (110) surface: structure and dynamics

P. Mulheran, C. Browne, Y. Moghaddam, 2009 .

Deposition and diffusion of size-selected (Ag400+) clusters on a stepped graphite surface

P. Mulheran, R. Palmer, S. Hobday, 1998 .

Mechanism of hen egg white lysozyme adsorption on a charged solid surface.

P. Mulheran, Karina Kubiak-Ossowska, 2010, Langmuir : the ACS journal of surfaces and colloids.

Rationalising drug delivery using nanoparticles: a combined simulation and immunology study of GnRH adsorbed to silica nanoparticles

Siddharth V. Patwardhan, P. Mulheran, V. Ferro, 2018, Scientific Reports.

Surface and interstitial transition barriers in rutile (110) surface growth

L. Vernon, P. Mulheran, E. Sanville, 2009 .