Accelerated Molecular Dynamics for Peptide Folding: Benchmarking Different Combinations of Force Fields and Explicit Solvent Models

Summary

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Authors: Crescenzo Coppa, Andrea Bazzoli, Maral Barkhordari, and Alessandro Contini

Journal title: Journal of Chemical Information and Modeling

Journal publisher: ACS publication

Published year: 2023

DOI identifier: 10.1021/acs.jcim.3c00138

ISSN: 1549-9596