Molecular Generation
Benchmarks
Dataset NameSOTA methodMetricTrendResultsLast Updated
312.7# Circles
12
Feb 26, 2026
254.3#Circles
12
Feb 26, 2026
215Number of Circles
12
Feb 26, 2026
1Uniqueness
12
Feb 26, 2026
0.781Amlo (AUC-Top10)
10
Feb 26, 2026
0.495FCD
10
Feb 26, 2026
99.5Uniqueness
10
Feb 26, 2026
0.828FCD
10
Feb 26, 2026
60.9Validity
9
May 12, 2026
100Validity
9
Mar 31, 2026
99.76Validity
9
Feb 26, 2026
100Validity
9
Feb 26, 2026
99Atom Stability
8
Feb 26, 2026
87Validity
7
Jun 4, 2026
33.1COVR
7
Feb 26, 2026
69.65COVR
7
Feb 26, 2026
98Validity
6
Jun 4, 2026
42.1Exact Match
6
Apr 7, 2026
99.38Validity
6
Mar 9, 2026
365.6Molecular Weight
6
Feb 26, 2026
423Molecular Weight
6
Feb 26, 2026
558.7Molecular Weight
6
Feb 26, 2026
411.1Molecular Weight
6
Feb 26, 2026
57.8Validity
5
May 22, 2026
100Validity
5
Apr 13, 2026