Xiaojing Wu
Affiliations: | 2019-2021 | University College London |
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| Futera Z, Wu X, Blumberger J. (2023) Tunneling-to-Hopping Transition in Multiheme Cytochrome Bioelectronic Junctions. The Journal of Physical Chemistry Letters. 14: 445-452 |
| van Wonderen JH, Adamczyk K, Wu X, et al. (2021) Nanosecond heme-to-heme electron transfer rates in a multiheme cytochrome nanowire reported by a spectrally unique His/Met-ligated heme. Proceedings of the National Academy of Sciences of the United States of America. 118 |
| Wu X, Hénin J, Baciou L, et al. (2021) Mechanistic Insights on Heme-to-Heme Transmembrane Electron Transfer Within NADPH Oxydases From Atomistic Simulations. Frontiers in Chemistry. 9: 650651 |
| de la Lande A, Alvarez-Ibarra A, Hasnaoui K, et al. (2019) Molecular Simulations with in-deMon2k QM/MM, a Tutorial-Review. Molecules (Basel, Switzerland). 24 |
| Wu X, Clavaguera C, Lagardère L, et al. (2018) AMOEBA Polarizable Force Field Parameters of the Heme Cofactor in Its Ferrous and Ferric Forms. Journal of Chemical Theory and Computation. 14: 2705-2720 |
| Parise A, Alvarez-Ibarra A, Wu X, et al. (2018) Quantum Chemical Topology of the Electron Localization Function in the Field of Attosecond Electron Dynamics. The Journal of Physical Chemistry Letters |
| Parise A, Alvarez-Ibarra A, Wu X, et al. (2018) Quantum Chemical Topology of the Electron Localization Function in the Field of Attosecond Electron Dynamics. The Journal of Physical Chemistry Letters |
| Wu X, Teuler JM, Cailliez F, et al. (2017) Simulating Electron Dynamics in Polarizable Environments. Journal of Chemical Theory and Computation |
| Gillet N, Berstis L, Wu X, et al. (2016) Electronic Coupling Calculations for Bridge-Mediated Charge Transfer Using CDFT and Effective Hamiltonian approaches at DFT and FODFTB level. Journal of Chemical Theory and Computation |