3
Candidates
{"N": 8}
Ground Truth
{"N": 12}
Top-1 Prediction
0.667
Match Score
⚠ Per-candidate scores unavailable for sequential. Showing 30 candidates from single-ligand scoring.
For sequential results only top-1 prediction is stored.
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.27 ± 0.00
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#1
TOP-1
0.98 ± 0.01
Cc1cc(C)c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3nc2c1)c6c45
#1
TOP-1
0.16 ± 0.33
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1cccc2c4nc5cc(C)cc(C)c5nc4c4ccc[n]->3c4c21
#1
TOP-1
0.20 ± 0.43
Cc1cc[n]2->[Ru+2]34(<-[n]5ccc(C)cc5-c2c1)(<-[n]1ccc(C)cc1-c1cc(C)cc[n]->31)<-[n]1cccc2c3nc5cc(C)cc(C...
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.08 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)<-[n]1c2cc(C)cc(C)c2[n]->3c2c3cccnc3c3ncccc3c21
#2
0.47 ± 0.13
Cc1cc(C)c2c(c1)[n]1->[Ru+2]<-[n]2c2c3cccnc3c3ncccc3c21
#2
0.00 ± 0.00
Cc1ccnc(-c2cc(C)cc[n]2->[Ru+2]2<-[n]3cccc4c5nc6cc(C)cc(C)c6nc5c5ccc[n]->2c5c43)c1
#2
0.00 ± 0.00
Cc1ccnc(-c2cc(C)cc[n]2->[Ru+2]23(<-[n]4ccc(C)cc4-c4cc(C)cc[n]->24)<-[n]2cccc4c5nc6cc(C)cc(C)c6nc5c5c...
#3
0.02 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)(<-[n]1ccc(C)cc1-c1cc(C)cc[n]->31)<-[n]1c2c(C)cc(C)cc2nc2c3c...
#3
0.02 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)(<-[n]1ccc(C)cc1-c1cc(C)cc[n]->31)<-[n]1c2c(C)cc(C)cc2nc2c3c...
#3
0.02 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)(<-[n]1ccc(C)cc1-c1cc(C)cc[n]->31)<-[n]1c2c(C)cc(C)cc2nc2c3c...
#3
0.02 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)(<-[n]1ccc(C)cc1-c1cc(C)cc[n]->31)<-[n]1c2c(C)cc(C)cc2nc2c3c...
#3
0.02 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)(<-[n]1ccc(C)cc1-c1cc(C)cc[n]->31)<-[n]1c2c(C)cc(C)cc2nc2c3c...
#3
0.02 ± 0.00
Cc1cc[n]2->[Ru+2]3(<-[n]4ccc(C)cc4-c2c1)(<-[n]1ccc(C)cc1-c1cc(C)cc[n]->31)<-[n]1c2c(C)cc(C)cc2nc2c3c...