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MM/GBSA-based binding energy profile of CaMKIV in complex with quercetin and EA.
| Complex | ΔEvdW | ΔEelec | ΔGgas | ΔGpolar | ΔGnonpolar | ΔGsolvation | ΔGbind |
|---|---|---|---|---|---|---|---|
| Quercetin-CaMKIV | -33.69 | -26.51 | -60.20 | 41.03 | -4.58 | 36.45 | -23.75 |
| EA-CaMKIV | -25.90 | -29.42 | -55.32 | 30.43 | -4.26 | 26.18 | -29.15 |
