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doi: 10.1210/en.2014-1519 85 HuangZHuangLWangCZhuSQiXChenYet al
Several mechanisms, including natural aging, alterations in the hypothalamic-pituitary-ovarian axis (Wang et al., 2023a), DNA damage (Wu et al., 2024
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Full geometry optimizations, relaxed scans and transition structure searches were carried out with Gaussian 16 83 with the ONIOM 84 QM/MM method using the B3LYP hybrid functional 85 and 6-31 G(d) basis set with ultrafine integration grids for the QM part and the ff14SB 78 , gaff2 79 and TIP3P 86 force fields for the MM part (protein, substrate and water, respectively) with electrostatic embedding
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