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5 results in Authors: John Shelley

Biological and Medicinal Chemistry

Calculating Apparent pKa Values of Ionizable Lipids in Lipid Nanoparticles

Nicholas B. Hamilton, Steve Arns, Mee Shelley, Irene Bechis, John C. Shelley

Version 2 posted 29 March 2024

390

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Materials Science

Shearing Friction Behaviour of Synthetic Polymers Compared to a Functionalized Polysaccharide on Biomimetic Surfaces: Models for the Prediction of Performance of Eco-designed Formulations

Benjamin J. Coscia, John C. Shelley, Andrea R. Browning, Jeffrey M. Sanders, Robin Chaudret, Roger Rozot, Fabien Léonforte, Mathew D. Halls, Gustavo S. Luengo

Version 2 posted 14 October 2022

424

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Theoretical and Computational Chemistry

Coarse-Grained Simulation of mRNA-Loaded Lipid Nanoparticle Self-Assembly

Douglas Grzetic, Nicholas Hamilton, John Shelley

Version 1 posted 26 February 2024

302

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Theoretical and Computational Chemistry

Epik: pKa and Protonation State Prediction through Machine Learning

Ryne C. Johnston, Kun Yao, Zachary Kaplan, Monica Chelliah, Karl Leswing, Sean Seekins, Shawn Watts, David Calkins, Jackson Chief Elk, Steven V. Jerome, Matthew P. Repasky, John C. Shelley

Version 3 posted 27 March 2023

1,916

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Agriculture and Food Chemistry

Characterizing Moisture Uptake and Plasticization Effects of Water on Amorphous Amylose Starch Models Using Molecular Dynamics Methods

Jeffrey Sanders, Mayank Misra, Thomas JL Mustard, David J. Giesen, Teng Zhang, John Shelley, Mathew D. Halls

Version 3 posted 03 July 2020

534

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