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Reproduction of macroscopic properties of unsaturated triacylglycerides using a modified NERD force field

Robert J Cordina1, Beccy Smith2, Tell Tuttle3

  • 1Mondelēz UK R&D Ltd., PO Box 12, Bournville Lane, Birmingham B30 2LU, UK; Department of Pure and Applied Chemistry, University of Strathclyde, 295 Cathedral Street, Glasgow, G1 1XL, UK.

Journal of Molecular Graphics & Modelling
|August 2, 2021
PubMed

Keywords:
MacropropertiesMolecular dynamicsNERDTriacylglyceridesUnsaturated

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