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Molecular dynamics simulations of glycine, lysine and arginine nonapeptides (G9, K9, R9) with hyaluronan (HA) (3)

Year: 2025

Type: article

Abstract: Molecular dynamics simulations of glycine (G9), lysine (K9), and arginine (R9) nonapeptides in the presence of hyaluronan (HA).This dataset includes starting structures, topology and parameter files, force fields, and GROMACS .tpr files necessary to reproduce the simulations. Final trajectory files are also provided. This repository contains one replica of the simulations. Other replicas can be accessed from: doi.org/10.5281/zenodo.15115660

Source: Zenodo (CERN European Organization for Nuclear Research)

DOI: 10.5281/zenodo.15302557

Author: Riopedre Fernandez, Miguel

Institutions: Czech Academy of Sciences, Czech Academy of Sciences, Institute of Organic Chemistry and Biochemistry

Language: English

Topic: Protein Structure and Dynamics

Subfield: Molecular Biology

Field: Biochemistry, Genetics and Molecular Biology

Domain: Life Sciences

Open Access status: green

OpenAlex ID: W7081646709

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