Table 3:

Result for the ClinTox dataset.

ClinTox	Training	Validation	Testing
Experimental set-up 1	0.932	0.93	0.921
Experimental set-up 2	0.931	0.929	0.927
Experimental set-up 3	0.942	0.942	0.94
Experimental set-up 4	0.932	0.932	0.933
Experimental set-up 5	0.935	0.928	0.934
Experimental set-up 6	0.933	0.929	0.931
Graph convolution [21]	0.962	0.920	0.807