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Published in 2020 at "Computational and Theoretical Chemistry"
DOI: 10.1016/j.comptc.2020.112905
Abstract: Abstract Antioxidant activities based on iron ions chelation of ferulic acid (FA) in competition with its pro-oxidant risk have been investigated. Reaction enthalpies (ΔrH0) and Gibbs free energies (ΔrG0) of chelation reaction between the neutral…
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Keywords:
pro oxidant;
iron ions;
oxidant risk;