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The Journal of Biological Chemistry|June 13, 2025
Ancestral evolution of oxidase activity in a class of (S)-nicotine and (S)-6-hydroxynicotine degrading flavoenzymesZhiyao Zhang, Parth R Bandivadekar, Andrew J Gaunt, et al.Plos One|September 7, 2019
Tamoxifen suppresses pancreatic β-cell proliferation in miceSurl-Hee Ahn, Anne Granger, Matthew M Rankin, et al.Journal of Chemical Information and Modeling|June 14, 2024
Targeting Tuberculosis: Novel Scaffolds for Inhibiting Cytochrome bd OxidaseChristian Seitz, Surl-Hee Ahn, Haixin Wei, et al.The Journal of Physical Chemistry. B|October 13, 2025
Ligand Dissociation Pathways from Membrane Receptors Revealed by Weighted Ensemble SimulationsYanxiao Han, Kyle C Rouen, Vladimir Yarov-Yarovoy, et al.Journal of Chemical Theory and Computation|September 12, 2024
Stability and Dynamics of Zeolite-Confined Gold NanoclustersSiddharth Sonti, Chenghan Sun, Zekun Chen, et al.Biorxiv : the Preprint Server for Biology|March 13, 2023
Elucidating Molecular Mechanisms of Protoxin-2 State-specific Binding to the Human NaV1.7 ChannelKhoa Ngo, Diego Lopez Mateos, Yanxiao Han, et al.The Journal of General Physiology|December 21, 2023
Elucidating molecular mechanisms of protoxin-II state-specific binding to the human NaV1.7 channelKhoa Ngo, Diego Lopez Mateos, Yanxiao Han, et al.Iscience|February 3, 2025
Molecular simulations reveal intricate coupling between agonist-bound β-adrenergic receptors and G proteinYanxiao Han, John R D Dawson, Kevin R DeMarco, et al.Proceedings of the National Academy of Sciences of the United States of America|May 8, 2026
D614G reshapes allosteric networks and opening mechanisms of SARS-CoV-2 spikesFiona L Kearns, Anthony T Bogetti, Carla Calvó-Tusell, et al.Nature Communications|August 27, 2024
Simulation-driven design of stabilized SARS-CoV-2 spike S2 immunogensXandra Nuqui, Lorenzo Casalino, Ling Zhou, et al.Pageof 3