Research Article

Potential Material Basis of Yupingfeng Powder for the Prevention and Treatment of 2019 Novel Coronavirus Pneumonia: A Study Involving Molecular Docking and Molecular Dynamic Simulation Technology

Table 4

The analysis of binding energy for target with compound.

Energy typeBinding free energy/(kcal/mol)
WogoninKaempferolQuercetin

VDW-27.15-26.47-29.63
Eele-22.97-28.28-31.35
Egb30.3823.9921.62
Esurf-3.87-4.11-4.29
ΔG gas-36.21-35.97-35.4
ΔG solv25.2324.2320.23
ΔG total-15.49-15.61-18.91