Pengfei Li

Deciphering Atomic Polarizability: The Absolute Radii and Orbital Contributions Visited
Khatiwada, R. & Li, P., Jun 12 2025, In: Journal of Physical Chemistry A. 129, 23, p. 5118-5126 9 p.
Research output: Contribution to journal › Article › peer-review
Enhancing MM/P(G)BSA Methods: Integration of Formulaic Entropy for Improved Binding Free Energy Calculations
Dong, L., Li, P. & Wang, B., Apr 15 2025, In: Journal of Computational Chemistry. 46, 10, e70093.
Research output: Contribution to journal › Article › peer-review
Accuracy of Discrete-Continuum Solvation Model for Cations: A Benchmark Study
Hanson, B., Smith, M. & Li, P., Dec 5 2024, In: Journal of Physical Chemistry B. 128, 48, p. 11904-11913 10 p.
Research output: Contribution to journal › Article › peer-review
Development of Accurate Force Fields for Mg²⁺ and Triphosphate Interactions in ATP·Mg²⁺ and GTP·Mg²⁺ Complexes
Hu, F., Zhang, Y., Li, P., Wu, R. & Xia, F., Dec 10 2024, In: Journal of Chemical Theory and Computation. 20, 23, p. 10553-10563 11 p.
Research output: Contribution to journal › Article › peer-review
Development of a Fluctuating Charge Model for Zinc-Containing Metalloproteins
Landry, L. & Li, P., Feb 12 2024, In: Journal of Chemical Information and Modeling. 64, 3, p. 812-824 13 p.
Research output: Contribution to journal › Article › peer-review

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