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. 2022 Feb 4;22:35. doi: 10.1186/s12906-021-03488-8

Table 3.

Docking scores (kcal/mol) of curcumin, trans-resveratrol, quercetin and (1 s,4 s)-eucalyptol with protein 6K3F of CXCR 7 receptor

Compound Score rmsd_refine E_conf E_place E_score1 E_refine E_score2
Curcumin −7.17 1.05 −33.09 − 81.95 −10.17 − 33.42 − 7.17
Trans-resveratrol −5.49 1.71 −46.85 −67.60 −9.93 −27.15 − 5.49
Quercetin −6.03 1.20 5.11 −102.43 −11.59 −36.25 −6.03
(1 s,4 s)-Eucalyptol −4.70 2.15 −29.44 −29.89 −6.55 − 20.54 −4.70