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  Author Title Year Publication Volume Times cited Additional Links Links (down)
Heijkers, S.; Aghaei, M.; Bogaerts, A. Plasma-Based CH4Conversion into Higher Hydrocarbons and H2: Modeling to Reveal the Reaction Mechanisms of Different Plasma Sources 2020 Journal Of Physical Chemistry C 124 UA library record; WoS full record; WoS citing articles url doi
Cordeiro, R.M.; Yusupov, M.; Razzokov, J.; Bogaerts, A. Parametrization and Molecular Dynamics Simulations of Nitrogen Oxyanions and Oxyacids for Applications in Atmospheric and Biomolecular Sciences 2020 Journal Of Physical Chemistry B 124 UA library record; WoS full record; WoS citing articles pdf url doi
Nematollahi, P.; Neyts, E.C. Distribution pattern of metal atoms in bimetal-doped pyridinic-N₄ pores determines their potential for electrocatalytic N₂ reduction 2022 Journal Of Physical Chemistry A 126 UA library record; WoS full record pdf url doi
Bal, K.M.; Neyts, E.C. Merging Metadynamics into Hyperdynamics: Accelerated Molecular Simulations Reaching Time Scales from Microseconds to Seconds 2015 Journal of chemical theory and computation 11 41 UA library record; WoS full record; WoS citing articles pdf url doi
Tchakoua, T.; Gerrits, N.; Smeets, E.W.F.; Kroes, G.-J. SBH17 : benchmark database of barrier heights for dissociative chemisorption on transition metal surfaces 2023 Journal of chemical theory and computation 19 UA library record; WoS full record; WoS citing articles url doi
Bal, K.M. Reweighted Jarzynski sampling : acceleration of rare events and free energy calculation with a bias potential learned from nonequilibrium work 2021 Journal Of Chemical Theory And Computation 17 UA library record; WoS full record; WoS citing articles pdf url doi
Oliveira, M.C.; Yusupov, M.; Bogaerts, A.; Cordeiro, R.M. Lipid Oxidation: Role of Membrane Phase-Separated Domains 2021 Journal Of Chemical Information And Modeling 61 UA library record; WoS full record; WoS citing articles pdf url doi
Neyts, E.C.; Ostrikov, K.K.; Sunkara, M.K.; Bogaerts, A. Plasma Catalysis: Synergistic Effects at the Nanoscale 2015 Chemical reviews 115 204 UA library record; WoS full record; WoS citing articles pdf url doi
Gorbanev, Y.; Privat-Maldonado, A.; Bogaerts, A. Analysis of Short-Lived Reactive Species in Plasma–Air–Water Systems: The Dos and the Do Nots 2018 Analytical Chemistry 90 17 UA library record; WoS full record; WoS citing articles pdf url doi
Fuchs, J.; Aghaei, M.; Schachel, T.D.; Sperling, M.; Bogaerts, A.; Karst, U. Impact of the Particle Diameter on Ion Cloud Formation from Gold Nanoparticles in ICPMS 2018 Analytical chemistry 90 5 UA library record; WoS full record; WoS citing articles pdf url doi
Aghaei, M.; Lindner, H.; Bogaerts, A. Ion Clouds in the Inductively Coupled Plasma Torch: A Closer Look through Computations 2016 Analytical chemistry 88 9 UA library record; WoS full record; WoS citing articles pdf url doi
Girard-Sahun, F.; Lefrancois, P.; Badets, V.; Arbault, S.; Clement, F. Direct sensing of superoxide and its relatives reactive oxygen and nitrogen species in phosphate buffers during cold atmospheric plasmas exposures 2022 Analytical Chemistry 94 UA library record; WoS full record pdf url doi
Aghaei, M.; Bogaerts, A. Flowing Atmospheric Pressure Afterglow for Ambient Ionization: Reaction Pathways Revealed by Modeling 2021 Analytical Chemistry 93 UA library record; WoS full record; WoS citing articles pdf url doi
Khalilov, U.; Bogaerts, A.; Neyts, E.C. Toward the Understanding of Selective Si Nano-Oxidation by Atomic Scale Simulations 2017 Accounts of chemical research 50 5 UA library record; WoS full record; WoS citing articles pdf url doi
Hoffman, B.M.; Lukoyanov, D.; Yang, Z.-Y.; Dean, D.R.; Seefeldt, L.C. Mechanism of Nitrogen Fixation by Nitrogenase: The Next Stage 2014 Chemical Reviews 114 pdf url doi
Shah, J.; Wang, W.; Bogaerts, A.; Carreon, M.L. Ammonia Synthesis by Radio Frequency Plasma Catalysis: Revealing the Underlying Mechanisms 2018 ACS applied energy materials 1 UA library record; WoS full record; WoS citing articles pdf url doi
Michiels, R.; Engelmann, Y.; Bogaerts, A. Plasma Catalysis for CO2Hydrogenation: Unlocking New Pathways toward CH3OH 2020 Journal Of Physical Chemistry C 124 UA library record; WoS full record; WoS citing articles pdf url doi
Ghasemitarei, M.; Privat-Maldonado, A.; Yusupov, M.; Rahnama, S.; Bogaerts, A.; Ejtehadi, M.R. Effect of Cysteine Oxidation in SARS-CoV-2 Receptor-Binding Domain on Its Interaction with Two Cell Receptors: Insights from Atomistic Simulations 2022 Journal Of Chemical Information And Modeling 62 UA library record; WoS full record; WoS citing articles url doi
Nematollahi, P.; Esrafili, M.D.; Neyts, E.C. The role of healed N-vacancy defective BC2N sheet and nanotube by NO molecule in oxidation of NO and CO gas molecules 2018 Surface science : a journal devoted to the physics and chemistry of interfaces 672-673 1 UA library record; WoS full record; WoS citing articles pdf url doi
Cui, Z.; Hao, Y.; Jafarzadeh, A.; Li, S.; Bogaerts, A.; Li, L. The adsorption and decomposition of SF6 over defective and hydroxylated MgO surfaces: A DFT study 2023 Surfaces and interfaces 36 UA library record; WoS full record; WoS citing articles pdf url doi
Surmenev, R.A.; Grubova, I.Y.; Neyts, E.; Teresov, A.D.; Koval, N.N.; Epple, M.; Tyurin, A.I.; Pichugin, V.F.; Chaikina, M.V.; Surmeneva, M.A. Ab initio calculations and a scratch test study of RF-magnetron sputter deposited hydroxyapatite and silicon-containing hydroxyapatite coatings 2020 Surfaces and interfaces 21 UA library record; WoS full record; WoS citing articles pdf url doi
Vanraes, P.; Bogaerts, A. Laser-induced excitation mechanisms and phase transitions in spectrochemical analysis – Review of the fundamentals 2021 Spectrochimica Acta Part B-Atomic Spectroscopy 179 UA library record; WoS full record; WoS citing articles pdf url doi
Oliveira, M.C.; Verswyvel, H.; Smits, E.; Cordeiro, R.M.; Bogaerts, A.; Lin, A. The pro- and anti-tumoral properties of gap junctions in cancer and their role in therapeutic strategies 2022 Redox Biology 57 UA library record; WoS full record url doi
De Backer, J.; Lin, A.; Berghe, W.V.; Bogaerts, A.; Hoogewijs, D. Cytoglobin inhibits non-thermal plasma-induced apoptosis in melanoma cells through regulation of the NRF2-mediated antioxidant response 2022 Redox Biology 55 UA library record; WoS full record; WoS citing articles url doi
Yusupov, M.; Privat-Maldonado, A.; Cordeiro, R.M.; Verswyvel, H.; Shaw, P.; Razzokov, J.; Smits, E.; Bogaerts, A. Oxidative damage to hyaluronan–CD44 interactions as an underlying mechanism of action of oxidative stress-inducing cancer therapy 2021 Redox Biology 43 UA library record; WoS full record; WoS citing articles url doi
De Backer, J.; Razzokov, J.; Hammerschmid, D.; Mensch, C.; Hafideddine, Z.; Kumar, N.; van Raemdonck, G.; Yusupov, M.; Van Doorslaer, S.; Johannessen, C.; Sobott, F.; Bogaerts, A.; Dewilde, S. The effect of reactive oxygen and nitrogen species on the structure of cytoglobin: A potential tumor suppressor 2018 Redox Biology 19 UA library record; WoS full record; WoS citing articles pdf url doi
Bal, K.M.; Cautereels, J.; Blockhuys, F. Structures and spectroscopic properties of sulfur-nitrogen-pnictogen chains : R2P-N=S=N-PR2 and R2P-N=S=N-AsR2 2017 Journal of molecular structure 1132 UA library record; WoS full record pdf url doi
Kelly, S.; Bogaerts, A. Nitrogen fixation in an electrode-free microwave plasma 2021 Joule 5 UA library record; WoS full record; WoS citing articles pdf url doi
Wardenier, N.; Vanraes, P.; Nikiforov, A.; Van Hulle, S.W.H.; Leys, C. Removal of micropollutants from water in a continuous-flow electrical discharge reactor 2019 Journal of hazardous materials 362 13 UA library record; WoS full record; WoS citing articles pdf url doi
Vanraes, P.; Wardenier, N.; Surmont, P.; Lynen, F.; Nikiforov, A.; Van Hulle, S.W.H.; Leys, C.; Bogaerts, A. Removal of alachlor, diuron and isoproturon in water in a falling film dielectric barrier discharge (DBD) reactor combined with adsorption on activated carbon textile: Reaction mechanisms and oxidation by-products 2018 Journal of hazardous materials 354 4 UA library record; WoS full record; WoS citing articles pdf url doi
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