| Oxidation of gold by oxygen-ion sputtering JM Gottfried, N Elghobashi, SLM Schroeder, K Christmann Surface science 523 (1-2), 89-102, 2003 | 90 | 2003 |
| IR+ UV laser pulse control of momenta directed to specific products: Quantum model simulations for HOD*→ H+ OD versus HO+ D N Elghobashi, P Krause, J Manz, M Oppel Physical Chemistry Chemical Physics 5 (21), 4806-4813, 2003 | 71 | 2003 |
| Molecular basis of cholesterol efflux via ABCG subfamily transporters Y Sun, J Wang, T Long, X Qi, L Donnelly, N Elghobashi-Meinhardt, ... Proceedings of the National Academy of Sciences 118 (34), e2110483118, 2021 | 51 | 2021 |
| Quantum model simulations of symmetry breaking and control of bond selective dissociation of using IR+UV laser pulses N Elghobashi, L González, J Manz The Journal of chemical physics 120 (17), 8002-8014, 2004 | 45 | 2004 |
| Mechanisms and inhibition of Porcupine-mediated Wnt acylation Y Liu, X Qi, L Donnelly, N Elghobashi-Meinhardt, T Long, RW Zhou, ... Nature 607 (7920), 816-822, 2022 | 38 | 2022 |
| A theoretical anharmonic study of the infrared absorption spectra of FHF−, FDF−, OHF−, and ODF− anions N Elghobashi, L González The Journal of Chemical Physics 124 (17), 2006 | 38 | 2006 |
| Breaking the strong and weak bonds of OHF− using few-cycle IR+ UV laser pulses N Elghobashi, L González Physical Chemistry Chemical Physics 6 (16), 4071-4073, 2004 | 32 | 2004 |
| Inter-domain dynamics drive cholesterol transport by NPC1 and NPC1L1 proteins P Saha, JL Shumate, JG Caldwell, N Elghobashi-Meinhardt, A Lu, ... Elife 9, e57089, 2020 | 30 | 2020 |
| Response of water to electric fields at temperatures below the glass transition: A molecular dynamics analysis X Hu, N Elghobashi-Meinhardt, D Gembris, JC Smith The Journal of chemical physics 135 (13), 2011 | 21 | 2011 |
| Separating the photofragments of randomly oriented symmetric reactants by IR + UV laser pulses: Quantum simulations for FHF− → F + FH + e N Elghobashi, J Manz Israel journal of chemistry 43 (3‐4), 293-303, 2003 | 18 | 2003 |
| Computational tools unravel putative sterol binding sites in the lysosomal NPC1 protein N Elghobashi-Meinhardt Journal of chemical information and modeling 59 (5), 2432-2441, 2019 | 17 | 2019 |
| Niemann–pick type C disease: a QM/MM study of conformational changes in cholesterol in the NPC1 (NTD) and NPC2 binding pockets N Elghobashi-Meinhardt Biochemistry 53 (41), 6603-6614, 2014 | 17 | 2014 |
| ProPairs: a data set for protein–protein docking F Krull, G Korff, N Elghobashi-Meinhardt, EW Knapp Journal of chemical information and modeling 55 (7), 1495-1507, 2015 | 16 | 2015 |
| Simulations of NPC1 (NTD): NPC2 protein complex reveal cholesterol transfer pathways M Hodošček, N Elghobashi-Meinhardt International journal of molecular sciences 19 (9), 2623, 2018 | 14 | 2018 |
| Quantum Simulations for isotope effects of IR+ UV laser pulses on symmetry and selective hydrogen bond breaking N Elghobashi, L González, J Manz Zeitschrift für Physikalische Chemie 217 (12), 1577-1596, 2003 | 14 | 2003 |
| Structural and functional insights into Spns2-mediated transport of sphingosine-1-phosphate H Chen, S Ahmed, H Zhao, N Elghobashi-Meinhardt, Y Dai, JH Kim, ... Cell 186 (12), 2644-2655. e16, 2023 | 12 | 2023 |
| Cholesterol transport in wild-type NPC1 and P691S: molecular dynamics simulations reveal changes in dynamical behavior N Elghobashi-Meinhardt International Journal of Molecular Sciences 21 (8), 2962, 2020 | 12 | 2020 |
| Few-cycle laser pulses to obtain spatial separation of OHF− dissociation products N Elghobashi-Meinhardt, L González, I Barth, T Seideman The Journal of chemical physics 130 (2), 2009 | 10 | 2009 |
| Modelling the active SARS-CoV-2 helicase complex as a basis for structure-based inhibitor design D Berta, M Badaoui, SA Martino, PJ Buigues, AV Pisliakov, ... Chemical Science 12 (40), 13492-13505, 2021 | 8 | 2021 |
| Electronic and Structural Properties of the Double Cubane Iron-Sulfur Cluster N Elghobashi-Meinhardt, D Tombolelli, MA Mroginski Catalysts 11 (2), 245, 2021 | 7 | 2021 |
