Qiang Cui
Orcid: 0000-0001-6214-5211Affiliations:
- Boston University, Department of Chemistry, Physics and Biomedical Engineering, MA, USA
According to our database1,
Qiang Cui
authored at least 5 papers
between 2017 and 2025.
Collaborative distances:
Collaborative distances:
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Bibliography
2025
Comparative Analysis of Polarizable and Nonpolarizable CHARMM Family Force Fields for Proteins with Flexible Loops and High Charge Density.
J. Chem. Inf. Model., 2025
Dynamic Electronic Structure Fluctuations in the De Novo Peptide ACC-Dimer Revealed by First-Principles Theory and Machine Learning.
J. Chem. Inf. Model., 2025
2022
Conformations and binding pockets of HRas and its guanine nucleotide exchange factors complexes in the guanosine triphosphate exchange process.
J. Comput. Chem., 2022
2019
Exploring the applicability of density functional tight binding to transition metal ions. Parameterization for nickel with the spin-polarized DFTB3 model.
J. Comput. Chem., 2019
2017
Benchmarking density functional tight binding models for barrier heights and reaction energetics of organic molecules.
J. Comput. Chem., 2017