Structural basis of the potential binding mechanism of remdesivir to SARS-CoV-2 RNA-dependent RNA polymerase L Zhang, R Zhou The Journal of Physical Chemistry B 124 (32), 6955-6962, 2020 | 157 | 2020 |
Robust Antibacterial Activity of Tungsten Oxide (WO3-x) Nanodots G Duan, L Chen, Z Jing, P De Luna, L Wen, L Zhang, L Zhao, J Xu, Z Li, ... Chemical research in toxicology 32 (7), 1357-1366, 2019 | 103 | 2019 |
Graphene oxide nanosheets retard cellular migration via disruption of actin cytoskeleton X Tian, Z Yang, G Duan, A Wu, Z Gu, L Zhang, C Chen, Z Chai, C Ge, ... Small 13 (3), 1602133, 2017 | 93 | 2017 |
Stability of ligands on nanoparticles regulating the integrity of biological membranes at the nano–lipid interface L Wang, P Quan, SH Chen, W Bu, YF Li, X Wu, J Wu, L Zhang, Y Zhao, ... ACS nano 13 (8), 8680-8693, 2019 | 68 | 2019 |
Lipid corona formation from nanoparticle interactions with bilayers LL Olenick, JM Troiano, A Vartanian, ES Melby, AC Mensch, L Zhang, ... Chem 4 (11), 2709-2723, 2018 | 63 | 2018 |
Different states of synaptotagmin regulate evoked versus spontaneous release H Bai, R Xue, H Bao, L Zhang, A Yethiraj, Q Cui, ER Chapman Nature communications 7 (1), 10971, 2016 | 59 | 2016 |
Anionic phospholipids stabilize RecA filament bundles in Escherichia coli M Rajendram, L Zhang, BJ Reynolds, GK Auer, HH Tuson, KV Ngo, ... Molecular cell 60 (3), 374-384, 2015 | 49 | 2015 |
Emerging β-sheet rich conformations in supercompact huntingtin exon-1 mutant structures H Kang, FX Vázquez, L Zhang, P Das, L Toledo-Sherman, B Luan, ... Journal of the American Chemical Society 139 (26), 8820-8827, 2017 | 44 | 2017 |
Binding specificity determines the cytochrome P450 3A4 mediated enantioselective metabolism of metconazole S Zhuang, L Zhang, T Zhan, L Lu, L Zhao, H Wang, JA Morrone, W Liu, ... The Journal of Physical Chemistry B 122 (3), 1176-1184, 2018 | 33 | 2018 |
Free energy calculations for the peripheral binding of proteins/peptides to an anionic membrane. 1. Implicit membrane models L Zhang, A Yethiraj, Q Cui Journal of Chemical Theory and Computation 10 (7), 2845-2859, 2014 | 29 | 2014 |
Modeling and structural characterization of the sweet taste receptor heterodimer JM Perez-Aguilar, S Kang, L Zhang, R Zhou ACS Chemical Neuroscience 10 (11), 4579-4592, 2019 | 26 | 2019 |
Generation and sensing of membrane curvature: where materials science and biophysics meet Q Cui, L Zhang, Z Wu, A Yethiraj Current Opinion in Solid State and Materials Science 17 (4), 164-174, 2013 | 25 | 2013 |
Ionic hydrogen bonds and lipid packing defects determine the binding orientation and insertion depth of RecA on multicomponent lipid bilayers L Zhang, M Rajendram, DB Weibel, A Yethiraj, Q Cui The Journal of Physical Chemistry B 120 (33), 8424-8437, 2016 | 24 | 2016 |
Simplified, interpretable graph convolutional neural networks for small molecule activity prediction JK Weber, JA Morrone, S Bagchi, JDE Pabon, S Kang, L Zhang, ... Journal of Computer-Aided Molecular Design, 1-14, 2022 | 16 | 2022 |
Parameterization of molybdenum disulfide interacting with water using the free energy perturbation method L Zhang, B Luan, R Zhou The Journal of Physical Chemistry B 123 (34), 7243-7252, 2019 | 16 | 2019 |
Structural perturbations on huntingtin N17 domain during its folding on 2D-nanomaterials L Zhang, M Feng, R Zhou, B Luan Nanotechnology 28 (35), 354001, 2017 | 13 | 2017 |
Molecular mechanism of stabilizing the helical structure of huntingtin N17 in a micellar environment L Zhang, H Kang, FX Vázquez, L Toledo-Sherman, B Luan, R Zhou The Journal of Physical Chemistry B 121 (18), 4713-4721, 2017 | 13 | 2017 |
Tethered spectroscopic probes estimate dynamic distances with subnanometer resolution in voltage-dependent potassium channels BW Jarecki, S Zheng, L Zhang, X Li, X Zhou, Q Cui, W Tang, B Chanda Biophysical journal 105 (12), 2724-2732, 2013 | 12 | 2013 |
Dynamics-based peptide–mhc binding optimization by a convolutional variational autoencoder: a use-case model for Castelo DR Bell, G Domeniconi, CC Yang, R Zhou, L Zhang, G Cong Journal of Chemical Theory and Computation 17 (12), 7962-7971, 2021 | 10 | 2021 |
CASTELO: clustered atom subtypes aided lead optimization—a combined machine learning and molecular modeling method L Zhang, G Domeniconi, CC Yang, S Kang, R Zhou, G Cong BMC bioinformatics 22, 1-21, 2021 | 9 | 2021 |