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Binding affinity of polyP estimated using different ligands for the PPK3 β subunit.

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Figshare2015-12-03 更新2026-04-29 收录
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Percentages in brackets indicated estimated energy relative to total values from 100 different runs. PM6 semi-empirical charges were added to the ligand atoms. All the ligands used in the study showed positive results for the β subunit.Binding affinity of polyP estimated using different ligands for the PPK3 β subunit.

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2015-12-03
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