Pengfei Li

32PUBLICATIONS
63CO-AUTHORS
Medical molecular engineering of nucleic acids and proteinsMain group metal chemistryMedical devicesAtomic and molecular physicsBiomolecular modelling and design
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Publications (32)

|Jul 27, 2026
Parameterization of the PA Endonuclease Bimetallic Center Reveals the Dynamics of Clinically Relevant Mutations.

|Jun 08, 2026
Beyond Single Structures: The Role of Structural Ensembles in Discrete-Continuum Modeling of Highly Charged Metal Ions.

|Sep 07, 2025
Electron Pushing: Variants That Alter the Catalytic Distribution of Electrons in Dihydroorotate Dehydrogenase 1B from Lactococcus lactis.

Corine O Smith, Richa Khatiwada, Pengfei Li

|May 29, 2025
Deciphering Atomic Polarizability: The Absolute Radii and Orbital Contributions Visited.

Richa Khatiwada, Pengfei Li

|Nov 21, 2024
Development of Accurate Force Fields for Mg2+ and Triphosphate Interactions in ATP·Mg2+ and GTP·Mg2+ Complexes.

Fangchen Hu, Yuwei Zhang, Pengfei Li

|Nov 21, 2024
Accuracy of Discrete-Continuum Solvation Model for Cations: A Benchmark Study.

Bailey Hanson, Madelyn Smith, Pengfei Li

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Frequent Collaborators

10 joint publications

Kenneth M Merz

7 joint publications

Sharon Hammes-Schiffer

6 joint publications

Zhen Li

5 joint publications

Madelyn Smith