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Table 10 Docking score of Hydroxytyrosol, oleuropein, pinoresinol, apigenin, and cardiovascular inhibitors against their target protein receptors

From: Evaluation of extra virgin olive oil compounds using computational methods: in vitro, ADMET, DFT, molecular docking and human gene network analysis study

Molecule

1O8A

4YAY

Hydroxytyrosol

− 6.0 kcal/mol

− 5.9 kcal/mol

Oleuropein

− 8.7 kcal/mol

− 7.8 kcal/mol

Pinoresinol

− 8.3 kcal/mol

− 8.5 kcal/mol

Apigenin

− 8.5 kcal/mol

− 8.2 kcal/mol

Inhibitors

− 7.0 kcal/mol

− 8.5 kcal/mol

Lisinopril

Losartan

  1. Docking score was expressed in kcal/mol
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BMC Chemistry

ISSN: 2661-801X

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