Table 13 The 
scores for converging Leave-5%-Out Cross Validation regression experiments.
scores for converging Leave-5%-Out Cross Validation regression experiments.Grammar | Dataset | Dataset Full Name |
|
|---|---|---|---|
SMILES | ACE | Angiotensin Converting Enzyme | 0.386±29.20 |
|  | AR | Androgen Receptor | 0.382±18.29 |
|  | ER | Estrogen Receptor | 0.349±21.82 |
|  | GPB | Glycogen Phosphorylase B | 0.253±43.18 |
|  | AChE | Acetylcholinesterase | 0.193±35.26 |
|  | Therm | Thermolysin | −0.288±210.30 |
InChI | ER | Estrogen Receptor | 0.476±11.16 |
|  | ACE | Angiotensin Converting Enzyme | 0.383±15.09 |
|  | Cox2 | Cyclooxygenase-2 | 0.279±8.97 |
|  | Therm | Thermolysin | 0.247±25.96 |
|  | AR | Androgen Receptor | 0.119±79.50 |
|  | Thr | Thrombin | 0.088±99.79 |
|  | AChE | Acetylcholinesterase | 0.061±39.70 |
|  | GPB | Glycogen Phosphorylase B | −0.180±104.87 |
