Mimosine

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This repository contains data from the manuscript "Influence of non-protein amino-acid mimosine in peptide conformational propensities from novel Amber force field parameters", by Asier Urriolabeitia, David De Sancho and Xabier López. Here you will be able to find the following: - Force field parameters in Gromacs format for the mimosine residue - Initial structures for the two peptides studied using classical MD simulations. - XYZ files for quantum chemical calculations.

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