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Molecular Property Prediction on QM9 (random test)

0.235alpha (bohr^3)

SchNet

Updated 3d ago

Evaluation Results

Method	Links
SchNet 2021.06		0.235	0.033	63	41	34	0.033	14	14	0.073	19	14	1.7
TFN 2021.06		0.223	0.064	58	40	38	0.101	-	-	-	-	-	-
SE(3)-Tr. 2021.06		0.142	0.051	53	35	33	0.054	-	-	-	-	-	-
NMP 2021.06		0.092	0.03	69	43	38	0.04	19	17	0.18	20	20	1.5
L1Net 2021.06		0.088	0.043	68	46	35	0.031	14	14	0.354	14	13	1.56
Cormorant 2021.06		0.085	0.038	61	34	38	0.026	20	21	0.961	21	22	2.03
LieConv 2021.06		0.084	0.032	49	30	25	0.038	22	24	0.8	19	19	2.28
EGNN 2021.06		0.071	0.029	48	29	25	0.031	12	12	0.106	12	11	1.55
SpinConv 2021.06		0.058	0.027	47	26	22	0.028	12	11	0.156	12	12	1.5
SphereNet 2021.06		0.047	0.027	32	24	19	0.022	8	6	0.292	7	6	1.12
DimeNet++ 2021.06		0.044	0.03	33	25	20	0.023	8	7	0.331	6	6	1.21