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Conformer Ensemble Generation on GEOM-QM9 (test)

91.52COV-R Mean

GeoMol

Updated 4d ago

Evaluation Results

Method	Links
GeoMol 2021.06		91.52	100	0.225	0.193	86.71	100	0.27	0.241
GEOMOL 2021.06		89.37	100	0.201	0.157	91.92	100	0.173	0.124
GraphDG 2021.06		88.7	100	0.21	0.165	90.14	100	0.185	0.129
OMEGA 2021.06		85.73	100	0.177	0.126	83.08	100	0.224	0.186
OMEGA 2021.06		85.51	100	0.177	0.126	82.86	100	0.224	0.186
RDKit/ETKDG 2021.06		85.13	100	0.235	0.199	86.8	100	0.232	0.205
RDKit/ETKDG 2021.06		83.48	100	0.219	0.172	89.78	100	0.16	0.116
CGCF 2021.06		75.45	100	0.313	0.246	50.29	50	0.518	0.52
GraphDG 2021.06		74.66	100	0.373	0.337	63.03	77.6	0.45	0.404
CGCF 2021.06		69.47	96.15	0.425	0.374	38.2	33.33	0.711	0.695