Publications
* corresponding author ·
† equal contribution
2026
Zhu, R., Zhu, T., Wu, R., & Xia, F.
J. Phys. Chem. B · 2026
coarse-grainedLennard-Jonessmall molecules
@article{10.1021/acs.jpcb.6c05069,
title = {A Coarse-Grained Model for Small Organic Molecules with Optimized Lennard-Jones Parameters},
author = {Zhu, R. and Zhu, T. and Wu, R. and Xia, F.},
journal = {The Journal of Physical Chemistry B},
year = {2026},
doi = {10.1021/acs.jpcb.6c05069}
}
Shi, J., Wan, Z., Zhu, R., & Cui, Q.
J. Chem. Theory Comput. · 2026 · 22(12), 6180–6195
allosteryprotein dynamicsMD simulation
@article{10.1021/acs.jctc.6c00082,
title = {Measuring Differences in Protein Allosteric Graphs Constructed via Molecular Dynamics Simulations},
author = {Shi, J. and Wan, Z. and Zhu, R. and Cui, Q.},
journal = {Journal of Chemical Theory and Computation},
volume = {22},
number = {12},
pages = {6180--6195},
year = {2026},
doi = {10.1021/acs.jctc.6c00082}
}
2025
Zhu, R., Zhang, Y., Zhu, T., & Xia, F.
J. Phys. Chem. Lett. · 2025
microtubulecoarse-grainedbiophysics
@article{zhu2025microtubule,
title = {Coarse-Grained Simulation of Persistence Length and Twisting Dynamics of Micrometer-Scale Microtubules},
author = {Zhu, R. and Zhang, Y. and Zhu, T. and Xia, F.},
journal = {J. Phys. Chem. Lett.},
year = {2025},
doi = {10.1021/acs.jpclett.5c01226}
}