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ΔGbind energies obtained from MM-GBSA calculation for various PDE variants.
| ΔGbind (kcal/mol) |
 #3 in the 2nd round |
#11 in the 2nd round |
|---|---|---|
| PDE4B (3G45) | −113.367 | −86.648 |
| PDE4D (3G4G) | −103.014 | −85.913 |
| PDE5A (2H42) | −68.768 | −67.397 |
| PDE10A (3HR1) | −69.916 | −92.082 |
