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Table 2 Post docking SP, XPG and MMGBSA scores of compounds from the AETt against human acetylcholinesterase target with scopoletin as standard

From: Insight into antioxidant-like activity and computational exploration of identified bioactive compounds in Talinum triangulare (Jacq.) aqueous extract as potential cholinesterase inhibitors

PubMed IUPAC

Docking score

XPG score

MMGBSA dG

binding score

Rutin

-14.34

-14.37

-73.21

Quercetin

-12.16

-12.19

-59.43

Luteolin

-11.71

-11.75

-57.76

Kaempferol

-10.69

-10.72

-45.85

Scopoletin

-7.91

-7.92

-37.87