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Binding energy between main active components and key protein targets (kJ/mol).
| Name of Chinese medicine | Number | Active ingredient | Protein name | Binding energy (kJ/mol) |
|---|---|---|---|---|
| Citrus reticulata (Chenpi) | MOL004328 | Baicalein | MAPK1 | −6.7 |
| Codonopsis pilosula (Dangshen) | MOL000006 | Quercetin | MAPK1 | −10.2 |
| Coptis chinensis (Huanglian) | MOL000098 | Tanshinone IIa | MAPK1 | −8.7 |
| Citrus reticulata (Chenpi) | MOL004328 | Kaempferol | MAPK3 | −7.0 |
