We were also interested in the performance of our model on molecules with a differing number of functional groups. To do so, we calculated the molecular perfection rate for compounds with one through six functional groups, for the original set of functional groups and the new set of functional groups (results shown in Figure ). Unfortunately, no definite conclusions can be made from this data as the original versus new functional group definitions follow very different patterns. However, the original set of functional groups outperforms the new set of definitions. This observation is likely due to the reduced accuracy of the new alkane due to the split into methyl and non-methyl groups as both have accuracies of 91% where the previous model had an accuracy of 95% (Figure ).