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Molecular dynamics is widely used in the analysis of conformational changes in the pockets of target proteins 44 , as well as in the design and research of inhibitors based on the structure of the target 45,46

In addition, simulations of the GSH adducts of TRaQ-G and MeTRaQ-G were performed following the protocol described above

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d-Carnitine feeding also induced hepatic inflammation, oxidative stress and apoptosis

If the OFV values reduction was more than 3.84 ( 2 , = 0.05, degrees of freedom (d.f.) = 1), the corresponding covariable met the inclusion criteria