Taoyu Niu

Publications (2)

Publications listed in the lab bibliography, across all years.

2025

Taoyu Niu, Junmei Wang, Zhen Huang, Ray Luo, Piotr Cieplak, Yong Duan (2025). Optimization of Lennard–Jones Parameters for Induced Dipole Polarizable Gaussian Multipole Force Field. The Journal of Physical Chemistry B.

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2024

Yong Duan, Taoyu Niu, Junmei Wang, Piotr Cieplak, Ray Luo (2024). PCMRESP: A Method for Polarizable Force Field Parameter Development and Transferability of the Polarizable Gaussian Multipole Models Across Multiple Solvents. Journal of Chemical Theory and Computation.

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