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  Author Title Year Publication Volume Times cited Additional Links Links
Amini, M.N.; Altantzis, T.; Lobato, I.; Grzelczak, M.; Sánchez-Iglesias, A.; Van Aert, S.; Liz-Marzán, L.M.; Partoens, B.; Bals, S.; Neyts, E.C. Understanding the Effect of Iodide Ions on the Morphology of Gold Nanorods 2018 Particle and particle systems characterization 35 6 UA library record; WoS full record; WoS citing articles url doi
Razzokov, J.; Yusupov, M.; Vanuytsel, S.; Neyts, E.C.; Bogaerts, A. Phosphatidylserine flip-flop induced by oxidation of the plasma membrane: a better insight by atomic scale modeling 2017 Plasma processes and polymers 14 9 UA library record; WoS full record; WoS citing articles pdf url doi
Neyts, E.C.; Bal, K.M. Effect of electric fields on plasma catalytic hydrocarbon oxidation from atomistic simulations 2017 Plasma processes and polymers 14 2 UA library record; WoS full record; WoS citing articles pdf doi
Neyts, E.C.; Brault, P. Molecular Dynamics Simulations for Plasma-Surface Interactions: Molecular Dynamics Simulations… 2017 Plasma processes and polymers 14 13 UA library record; WoS full record; WoS citing articles pdf url doi
Van der Paal, J.; Aernouts, S.; van Duin, A.C.T.; Neyts, E.C.; Bogaerts, A. Interaction of O and OH radicals with a simple model system for lipids in the skin barrier : a reactive molecular dynamics investigation for plasma medicine 2013 Journal of physics: D: applied physics 46 36 UA library record; WoS full record; WoS citing articles pdf doi
Bal, K.M.; Neyts, E.C. Quantifying the impact of vibrational nonequilibrium in plasma catalysis: insights from a molecular dynamics model of dissociative chemisorption 2021 Journal Of Physics D-Applied Physics 54 UA library record; WoS full record; WoS citing articles pdf url doi
Tinck, S.; Tillocher, T.; Dussart, R.; Neyts, E.C.; Bogaerts, A. Elucidating the effects of gas flow rate on an SF6inductively coupled plasma and on the silicon etch rate, by a combined experimental and theoretical investigation 2016 Journal of physics: D: applied physics 49 1 UA library record; WoS full record; WoS citing articles pdf url doi
Neyts, E.C.; Yusupov, M.; Verlackt, C.C.; Bogaerts, A. Computer simulations of plasmabiomolecule and plasmatissue interactions for a better insight in plasma medicine 2014 Journal of physics: D: applied physics 47 28 UA library record; WoS full record; WoS citing articles pdf doi
Neyts, E.C.; Bogaerts, A. Understanding plasma catalysis through modelling and simulation : a review 2014 Journal of physics: D: applied physics 47 130 UA library record; WoS full record; WoS citing articles pdf doi
Dufour, T.; Minnebo, J.; Abou Rich, S.; Neyts, E.C.; Bogaerts, A.; Reniers, F. Understanding polyethylene surface functionalization by an atmospheric He/O2 plasma through combined experiments and simulations 2014 Journal of physics: D: applied physics 47 13 UA library record; WoS full record; WoS citing articles pdf doi
Bogaerts, A.; Neyts, E.C.; Rousseau, A. Special issue on fundamentals of plasmasurface interactions 2014 Journal of physics: D: applied physics 47 2 UA library record; WoS full record; WoS citing articles doi
Bal, K.M.; Neyts, E.C. On the time scale associated with Monte Carlo simulations 2014 The journal of chemical physics 141 26 UA library record; WoS full record; WoS citing articles url doi
Bal, K.M.; Neyts, E.C. Extending and validating bubble nucleation rate predictions in a Lennard-Jones fluid with enhanced sampling methods and transition state theory 2022 Journal Of Chemical Physics 157 UA library record; WoS full record; WoS citing articles url doi
Khalilov, U.; Bogaerts, A.; Hussain, S.; Kovacevic, E.; Brault, P.; Boulmer-Leborgne, C.; Neyts, E.C. Nanoscale mechanisms of CNT growth and etching in plasma environment 2017 Journal of physics: D: applied physics 50 6 UA library record; WoS full record; WoS citing articles pdf url doi
Van der Paal, J.; Verlackt, C.C.; Yusupov, M.; Neyts, E.C.; Bogaerts, A. Structural modification of the skin barrier by OH radicals : a reactive molecular dynamics study for plasma medicine 2015 Journal of physics: D: applied physics 48 20 UA library record; WoS full record; WoS citing articles pdf url doi
Nematollahi, P.; Neyts, E.C. Direct methane conversion to methanol on M and MN4 embedded graphene (M = Ni and Si): a comparative DFT study 2019 Applied surface science 496 2 UA library record; WoS full record; WoS citing articles pdf doi
Mees, M.J.; Pourtois, G.; Neyts, E.C.; Thijsse, B.J.; Stesmans, A. Uniform-acceptance force-bias Monte Carlo method with time scale to study solid-state diffusion 2012 Physical review : B : condensed matter and materials physics 85 31 UA library record; WoS full record; WoS citing articles url doi
Kovács, A.; Yusupov, M.; Cornet, I.; Billen, P.; Neyts, E.C. Effect of natural deep eutectic solvents of non-eutectic compositions on enzyme stability 2022 Journal Of Molecular Liquids 366 UA library record; WoS full record pdf doi
Nematollahi, P.; Neyts, E.C. Direct oxidation of methane to methanol on Co embedded N-doped graphene: Comparing the role of N₂O and O₂ as oxidants 2020 Applied Catalysis A-General 602 UA library record; WoS full record; WoS citing articles pdf url doi
Faraji, F.; Neyts, E.C.; Milošević, M.V.; Peeters, F.M. Comment on “Misinterpretation of the Shuttleworth equation” 2024 Scripta Materialia 250 url doi
Bal, K.M.; Fukuhara, S.; Shibuta, Y.; Neyts, E.C. Free energy barriers from biased molecular dynamics simulations 2020 Journal Of Chemical Physics 153 UA library record; WoS full record; WoS citing articles pdf url doi
Fukuhara, S.; Bal, K.M.; Neyts, E.C.; Shibuta, Y. Accelerated molecular dynamics simulation of large systems with parallel collective variable-driven hyperdynamics 2020 Computational Materials Science 177 UA library record; WoS full record; WoS citing articles pdf url doi
Verlackt, C.C.W.; Neyts, E.C.; Jacob, T.; Fantauzzi, D.; Golkaram, M.; Shin, Y.-K.; van Duin, A.C.T.; Bogaerts, A. Atomic-scale insight into the interactions between hydroxyl radicals and DNA in solution using the ReaxFF reactive force field 2015 New journal of physics 17 18 UA library record; WoS full record; WoS citing articles pdf url doi
Yusupov, M.; Neyts, E.C.; Khalilov, U.; Snoeckx, R.; van Duin, A.C.T.; Bogaerts, A. Atomic-scale simulations of reactive oxygen plasma species interacting with bacterial cell walls 2012 New journal of physics 14 47 UA library record; WoS full record; WoS citing articles url doi
Neyts, E.C.; Ostrikov, K.; Han, Z.J.; Kumar, S.; van Duin, A.C.T.; Bogaerts, A. Defect healing and enhanced nucleation of carbon nanotubes by low-energy ion bombardment 2013 Physical review letters 110 50 UA library record; WoS full record; WoS citing articles url doi
Zhang, Y.-R.; Neyts, E.C.; Bogaerts, A. Enhancement of plasma generation in catalyst pores with different shapes 2018 Plasma sources science and technology 27 11 UA library record; WoS full record; WoS citing articles pdf url doi
Bogaerts, A.; Khosravian, N.; Van der Paal, J.; Verlackt, C.C.W.; Yusupov, M.; Kamaraj, B.; Neyts, E.C. Multi-level molecular modelling for plasma medicine 2016 Journal of physics: D: applied physics 49 11 UA library record; WoS full record; WoS citing articles pdf url doi
Bogaerts, A.; Khosravian, N.; Van der Paal, J.; Verlackt, C.C.W.; Yusupov, M.; Kamaraj, B.; Neyts, E.C. Multi-level molecular modelling for plasma medicine 2016 Journal Of Physics D-Applied Physics 49 UA library record pdf url
Bruggeman, P.J.; Kushner, M.J.; Locke, B.R.; Gardeniers, J.G.E.; Graham, W.G.; Graves, D.B.; Hofman-Caris, R.C.H.M.; Maric, D.; Reid, J.P.; Ceriani, E.; Fernandez Rivas, D.; Foster, J.E.; Garrick, S.C.; Gorbanev, Y.; Hamaguchi, S.; Iza, F.; Jablonowski, H.; Klimova, E.; Kolb, J.; Krcma, F.; Lukes, P.; Machala, Z.; Marinov, I.; Mariotti, D.; Mededovic Thagard, S.; Minakata, D.; Neyts, E.C.; Pawlat, J.; Petrovic, Z.L.; Pflieger, R.; Reuter, S.; Schram, D.C.; Schröter, S.; Shiraiwa, M.; Tarabová, B.; Tsai, P.A.; Verlet, J.R.R.; von Woedtke, T.; Wilson, K.R.; Yasui, K.; Zvereva, G. Plasma–liquid interactions: a review and roadmap 2016 Plasma sources science and technology 25 460 UA library record; WoS full record; WoS citing articles url doi
Van der Paal, J.; Verheyen, C.; Neyts, E.C.; Bogaerts, A. Hampering Effect of Cholesterol on the Permeation of Reactive Oxygen Species through Phospholipids Bilayer: Possible Explanation for Plasma Cancer Selectivity 2017 Scientific reports 7 27 UA library record; WoS full record; WoS citing articles pdf url doi
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