Refereed journal publications

    • A. Winter, B. Vorselaars, M. Esposito, A. Badiee, T. Price, P. P. Allport and N. Allinson, OPTIma: simplifying calorimetry for proton computed tomography in high proton flux environments, Phys. Med. Biol., (2024) pdf, doi, link
    • B. Vorselaars, Efficient Langevin and Monte Carlo sampling algorithms: the case of field-theoretic simulations, J. Chem. Phys., 158, 114117 (2023) pdf, doi, link
    • S. Ray, A. Banerjee, A. Swift, J. W. Fanstone, M. Mamalakis, B. Vorselaars, C. Wilkie, J. Cole, L. S. Mackenzie, S. Week, A robust COVID-19 mortality prediction calculator based on Lymphocyte count, Urea, C-Reactive Protein, Age and Sex (LUCAS) with chest X-rays, Sci. Rep., 12, 18220 (2022) pdf, doi, link
    • A.N. Boss, A. Banerjee, M. Mamalakis, S. Ray, A. J. Swift, C. Wilkie, J. W. Fanstone, B. Vorselaars, J. Cole, S. Weeks, L. S. Mackenzie, Development of a Mortality Prediction Model in Hospitalised SARS-CoV-2 Positive Patients Based on Routine Kidney Biomarkers, Int. J. Mol. Sci., 23, 7260 (2022) pdf, doi, link
    • M. Mamalakis, A.J. Swift, B. Vorselaars, S. Ray, S. Weeks, W. Ding, R.H. Clayton, L.S. Mackenzie, A. Banerjee, DenResCov-19: A deep transfer learning network for robust automatic classification of COVID-19, pneumonia, and tuberculosis from X-rays, Comput. Med. Imaging Graph., 94, 102008 (2021) pdf, doi, link
    • B. Vorselaars, R.K.W. Spencer, M.W. Matsen, Instability of the microemulsion channel in block copolymer-homopolymer blends, Phys. Rev. Lett., 125, 117801 (2020) pdf, doi, link
    • A. Banerjee, S. Ray, B. Vorselaars, J. Kitson, M. Mamalakis, S. Weeks, M. Baker, L. S. Mackenzie, Use of Machine Learning and Artificial Intelligence to predict SARS-CoV-2 infection from Full Blood Counts in a population, I. Immunopharmacology, 86, 106705 (2020) pdf, doi, link
    • N.E.R. Zimmermann, B. Vorselaars, J.R. Espinosa, D. Quigley, W.R. Smith, E. Sanz, C. Vega, B. Peters, NaCl nucleation from brine in seeded simulations: sources of uncertainty in rate estimates, J. Chem. Physics, 148, 222838 (2018) pdf, doi
    • R.K.W. Spencer, B. Vorselaars, M.W. Matsen, Continuous Thermodynamic Integration in Field-Theoretic Simulations of Structured Polymers, Macromol. Theory Simul., 26, 1700036 (2017) pdf, doi, featured
    • M. Ambler, B. Vorselaars, M. Allen, D. Quigley, Solid-liquid interfacial free energy of ice Ih, ice Ic and ice 0 within a mono-atomic model of water via the capillary wave method, J. Chem. Phys., 146, 074701 (2017) pdf, doi, link
    • Y. Lifanov, B. Vorselaars, D. Quigley, Nucleation Barrier Reconstruction via the Seeding Method in a Lattice Model with Competing Nucleation Pathways, J. Chem. Phys., 145, 211912 (2016) pdf, doi, link
    • B. Vorselaars, P. Stasiak, M.W. Matsen, Field-theoretic simulation of block copolymers at experimentally-relevant molecular weights, Macromolecules, 48, 9071-9080 (2015) pdf, doi
    • N. Zimmermann, B. Vorselaars, D. Quigley, B. Peters, Nucleation of NaCl from aqueous solution: critical sizes, ion-attachment kinetics, and rates, J. Am. Chem. Soc., 137, 13352-13361 (2015) pdf, doi, link
    • B. Vorselaars, A unified approach to computation of solid and liquid free energy to revisit the solid-fluid equilibrium of Lennard-Jones chains, J. Chem. Phys., 142, 114115, (2015) pdf, doi, link
    • A.E. Likhtman, M.S. Talib, B. Vorselaars, J. Ramirez, Determination of tube theory parameters using a simple grid model as an example, Macromolecules, 46, 1187-1200, (2013) pdf, preprint, doi
    • B. Vorselaars, J.U. Kim, T.L. Chantawansri, G.H. Fredrickson, M.W. Matsen, Self-consistent field theory for diblock copolymers grafted to a sphere, Soft Matter, 7, 5128-5137, (2011) pdf, doi, hot article, cover
      On the cover of Soft Matter
    • G.H. Griffiths, B. Vorselaars, M.W. Matsen, Diblock-copolymer brushes grafted to spherical particles, Macromolecules, 44, 3649-3655, (2011) pdf, doi
    • J. Ramirez, S. Sukumaran, B. Vorselaars, A.E. Likhtman, Efficient on the fly calculation of time correlation functions in computer simulations, J. Chem. Phys., 133, 154103-1-12, (2010) pdf, doi, top 20 downloads, simple C++ code for the multiple tau correlator and LAMMPS implementation
    • B. Vorselaars, A.V. Lyulin, M.A.J. Michels, Microscopic Mechanisms of Strain Hardening in Glassy Polymers, Macromolecules, 42, issue 15, 5829-5842, (2009) pdf, doi

    • B. Vorselaars, A.V. Lyulin, M.A.J. Michels, Deforming glassy polystyrene: influence of pressure, thermal history and deformation mode on yielding and hardening, J. Chem. Phys., 130, 074905-1-14, (2009) and Virtual J. Biological Physics Research, 17, issue 5, (2009) pdf, doi
    • T. Mulder, V.A. Harmandaris, A.V. Lyulin, N.F.A. van der Vegt, B. Vorselaars, M.A.J. Michels, Equilibration and deformation of amorphous polystrene: scale-jumping simulational approach, Macromol. Theor. Simul., 17, 290-300, (2008) pdf, doi
    • B. Vorselaars, A.V. Lyulin, M.A.J. Michels, Development of heterogeneity near the glass transition: phenyl-ring-flip motions in polystyrene, Macromolecules, 40, 6001-6011, (2007) doi, thesis
    • B. Vorselaars, A.V. Lyulin, K. Karatasos, M.A.J. Michels, Non-Gaussian nature of glassy dynamics by cage to cage motion, Phys. Rev. E, 75, 01154-1-6, (2007) and Virtual J. Biological Physics Research, 13, issue 3, (2007) pdf, doi
    • A.V. Lyulin, J. Li, T. Mulder, B. Vorselaars, M.A.J. Michels, Atomistic simulation of bulk mechanics and local dynamics of amorphous polymers, Macromol. Symp., 237, 108-118, (2006) pdf, doi
    • J. Li, T. Mulder, B. Vorselaars, A.V. Lyulin, M.A.J. Michels, Monte Carlo simulation of uniaxial tension of an amorphous polyethylene-like polymer glass, Macromolecules, 39, 7774-7782, (2006) pdf, doi
    • A.V. Lyulin, B. Vorselaars, M.A. Mazo, N.K. Balabaev, M.A.J. Michels, Strain softening and hardening of amorphous polymers: atomistic simulation of bulk mechanics and local dynamics, Europhysics Letters, 71, 618-624, (2005) pdf, doi
    • A.D. Staicu, B. Vorselaars, W. van de Water, Turbulence anisotropy and the SO(3) description, Phys. Rev. E,68(4), 046303-1-12, (2003) , pdf, doi

Non-refereed proceedings and other publications

    • B. Vorselaars, S. Ruzicka, D. Quigley, M.P. Allen, Folding kinetics of a polymer (corr), Phys. Chem. Chem. Phys. 19, 5674 (2017) pdf, doi, link (preprint on 19 (48), 21101, (2013) and arXiv:1611.00386)
    • A.V. Lyulin, B. Vorselaars, M.A.J. Michels, Molecular-dynamics simulation of amorphous polymers in the isotropic state and under uniaxial deformation, in Proceedings of the CIMTEC conference; Editors: P. Vincenzini and A. Lami, Sicily, Italy, 743-750, (2004) pdf


    • B. Vorselaars, Universality of anisotropic turbulence, R-1601-S, Technische Universiteit Eindhoven, Eindhoven, The Netherlands (2003)
    • B. Vorselaars, Disturbing the mixing layer of a round yet by independent piezo actuators, R-1558-S, Technische Universiteit Eindhoven, Eindhoven, The Netherlands (2001)
    • B. Vorselaars, A collisional radiative model for neon in neon-mercury fluorescent lamps, VDF/NT 00-07, Technische Universiteit Eindhoven, Eindhoven, The Netherlands (2000)

PhD thesis

  • Bart Vorselaars, Local dynamics and deformation of glass-forming polymers: modelling and atomistic simulations, Technische Universiteit Eindhoven, Eindhoven, The Netherlands (2008) pdf, doi, link

External lists