Table 4.
PNN and LAD correlations obtained for the linear combination model (results for 76 polymers are shown).
Method | Stoichiom. ratio | Pearson r
|
Number of descriptors | Dataset | |
---|---|---|---|---|---|
Model | X-validation | ||||
PNN | 1:1 | 0.53 | – | 472 | Extended |
1.2:1 | 0.54 | – | 472 | Extended | |
LAD | 1.2:1 | 0.94 | 0.22 | 472 | Extended |
1.2:1 | 0.91 | 0.26 | 42 | Selected |