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Statistical results for KECSA, KECSA LJ, KECSA entropy and Ligand MW correlated with experimental binding affinity.
| Pearson's r | Kendall τ | |
|---|---|---|
| KECSA Scoring | ||
| Function | 0.590 | 0.404 |
| LJ Potentials in KECSA | 0.509 | 0.352 |
| Entropy in KECSA | 0.521 | 0.349 |
| Ligand Molecular Weight | 0.381 | 0.272 |
