Data for: "Chitin and Chitosan Binding to the α-Chitin Crystal: A Molecular Dynamics Study"

Dataset

Description

This dataset was obtained for the paper: "Chitin and Chitosan Binding to the α-Chitin Crystal: A Molecular Dynamics Study"

The dataset includes data obtained from molecular dynamics simulations and contains the input files required for the recreation of the simulations, alongside the energy, velocity, coordinates and collective variable outputs. The data is in the NAMD (open-source software) standard formats. Further description of the data is available in the readme files which accompany the dataset.
Date made available9 Jan 2023
PublisherUniversity of Strathclyde

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