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The macromolecular receptor was processed using AutoDockTools 1.5.7 software, including the addition of hydrogen bonds, calculation of charges, setting of rigid structures, and designation as the receptor, and then exported in PDBQT format

doi: 10.1111/j.1469-8749.1989.tb03973.x 73 WanYKangQWangYLuXLiJNieHet al

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