Madelyn Smith

5PUBLICATIONS
7CO-AUTHORS
Computational chemistryAtomic and molecular physicsMechanobiologyInstruments and techniquesProteins and peptides
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Publications (5)

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

Bailey Hanson, Madelyn Smith, Pengfei Li

|Sep 28, 2024
Exploring Ion Polarizabilities and Their Correlation with van der Waals Radii: A Theoretical Investigation.

Madelyn Smith, Richa Khatiwada, Pengfei Li

|Jul 31, 2024
Simulating Metal-Imidazole Complexes.

Zhen Li, Subhamoy Bhowmik, Luca Sagresti

|Mar 23, 2023
Consequences of Overfitting the van der Waals Radii of Ions.

Madelyn Smith, Zhen Li, Luke Landry

|Dec 12, 2022
Molecular Insights into the Calcium Binding in Troponin C through a Molecular Dynamics Study.

Madelyn Smith, Pengfei Li

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Frequent Collaborators

5 joint publications

Pengfei Li

2 joint publications

Zhen Li

2 joint publications

Kenneth M Merz

1 joint publications

Subhamoy Bhowmik