3
Candidates
{"N": 6}
Ground Truth
{"N": 12}
Top-1 Prediction
0.500
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
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.05 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#1
TOP-1
0.46 ± 0.32
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3nc4c5ccc[n]6->[Ru+2]<-[n]7cccc(c4[nH]3)...
#1
TOP-1
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3nc4c5ccc[n]6->[Ru+2]7(<-[n]8ccccc8-c8cc...
#1
TOP-1
0.05 ± 0.11
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3nc4c5ccc[n]6->[Ru+2]78(<-[n]9ccccc9-c9c...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.03 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]34(...
#2
0.07 ± 0.12
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn2-c3ccc(/C=C/c4[nH]c5c6cccnc6c6ncccc6c5[n]4->[Ru+2]<-[...
#2
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3nc4c5ccc[n]6->[Ru+2]78(<-[cH]9ccnc(-c%1...
#2
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3nc4c5ccc[n]6->[Ru+]789(<-[cH]%10cnc(-c%...
#3
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2])cc...
#3
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2])cc...
#3
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2])cc...
#3
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2])cc...
#3
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2])cc...
#3
0.00 ± 0.00
O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2])cc...