Is EC class predictable from reaction mechanism?

BMC Bioinformatics

Table 3 Prediction accuracies by EC class

Package & Method	randomForest, Random Forest
EC Class	1	2	3	4	5	6
Human Designed	0.961	0.816	0.948	0.835	0.952	0.877
Overall Bond Change	0.823	0.394	0.849	0.605	0.500	0.731
Overall Reaction Similarity	0.865	0.500	0.828	0.568	0.628	0.600
Composite Bond Change	0.870	0.406	0.680	0.495	0.276	0.654
Mechanistic Similarity	0.817	0.363	0.722	0.334	0.333	0.315

Prediction accuracies by EC class and descriptor type. These data are for the RF method as implemented in the R package randomForest [48].

ISSN: 1471-2105