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Fig. 3 | BMC Complementary Medicine and Therapies

Fig. 3

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

Fig. 3

a&b Molecular mechanics/generalized born surface area value (MMGBSA) for a rutin dynamics binding to AChE; b quercetin dynamics binding to BChE. Note: VDWAAL Van der Waals, EEL Electrostatic, EGB Generalized born electrostatic, ESURF Nonpolar solvation, DELTA G gas Calculated free energy of binding (ΔG gas), DELTA G Solv Solvation contribution, DELTA TOTAL overall binding energy (ΔG total)

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BMC Complementary Medicine and Therapies

ISSN: 2662-7671

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