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Blind docking statistics of anthocyanidins against GKRP sorted by the lowest binding free energy.

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posted on 2023-07-19, 17:36 authored by Christian Kenneth, Daru Seto Bagus Anugrah, Jeffry Julianus, Sendy Junedi
<p>Blind docking statistics of anthocyanidins against GKRP sorted by the lowest binding free energy.</p>

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    DOI - Is supplement to Molecular insights into the inhibitory potential of anthocyanidins on glucokinase regulatory protein

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    quantum chemical propertieslower rmsf valuesderived natural productsdensity functional theoryblind docking resultsdel ), cyanidinblind docking methodshowing high gkrpmolecular dynamics studymolecular docking studyindicating pelargonidin abilityhigh binding affinityf1p complex stabilitypotential gkrp inhibitorsmolecular insightsgbsa methodcya ),pivotal gkkey residuesinteracting residuesinhibitory potentialinactive conformationgk bindingalso identified

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