Analysis of phthalate plasticizer migration from PVDC packaging materials to food simulants using molecular dynamics simulations and artificial neural network

Title
Analysis of phthalate plasticizer migration from PVDC packaging materials to food simulants using molecular dynamics simulations and artificial neural network
Authors
Keywords
Molecular dynamics, Artificial neural network, Plasticizer, Two-component solubility parameters, Fractional free volume, Migration, PVDC
Journal
FOOD CHEMISTRY
Volume 317, Issue -, Pages 126465
Publisher
Elsevier BV
Online
2020-02-22
DOI
10.1016/j.foodchem.2020.126465

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