3
Candidates
{"N": 8}
Ground Truth
{"N": 9}
Top-1 Prediction
0.889
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
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.99 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]<-[n](c1)c2c34
#1
TOP-1
0.79 ± 0.19
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]<-[n]5cccc(c2[nH]1)c5c34
#1
TOP-1
0.09 ± 0.19
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[n]6cccc7ccc8ccc[n]->5c8c76)<-[n]5cccc(c2[nH]1)c5c34
#1
TOP-1
0.15 ± 0.34
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[n]7cccc8ccc9ccc[n]->5c9c87)(<-[n]5cccc7ccc8ccc[n]->6c8c75)<-[...
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.23 ± 0.00
c1cc2ccc3ccc[n]4->[Ru+2]5(<-[n](c1)c2c34)<-[n]1cccc2ccc3ccc[n]->5c3c21
#2
0.16 ± 0.15
COc1ccccc1-c1[nH]c2c3ccc[n]4->[Ru+2]5<-[n]6cccc(c6c34)c2[n]->51
#2
0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[n]6cccc(c2[nH]1)c6c34)[CH]1C=Nc2c(ccc3cccnc23)[CH]15
#2
0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[n]6cccc7ccc8cccnc8c76)(<-[n]6cccc7ccc8ccc[n]->5c8c76)<-[n]5ccc...
#3
0.02 ± 0.00
COc1ccccc1-c1nc2c3ccc[n](->[Ru+2]4<-[n]5cccc6ccc7ccc[n]->4c7c65)c3c3ncccc3c2[nH]1
#3
0.02 ± 0.00
COc1ccccc1-c1nc2c3ccc[n](->[Ru+2]4<-[n]5cccc6ccc7ccc[n]->4c7c65)c3c3ncccc3c2[nH]1
#3
0.02 ± 0.00
COc1ccccc1-c1nc2c3ccc[n](->[Ru+2]4<-[n]5cccc6ccc7ccc[n]->4c7c65)c3c3ncccc3c2[nH]1
#3
0.02 ± 0.00
COc1ccccc1-c1nc2c3ccc[n](->[Ru+2]4<-[n]5cccc6ccc7ccc[n]->4c7c65)c3c3ncccc3c2[nH]1
#3
0.02 ± 0.00
COc1ccccc1-c1nc2c3ccc[n](->[Ru+2]4<-[n]5cccc6ccc7ccc[n]->4c7c65)c3c3ncccc3c2[nH]1
#3
0.02 ± 0.00
COc1ccccc1-c1nc2c3ccc[n](->[Ru+2]4<-[n]5cccc6ccc7ccc[n]->4c7c65)c3c3ncccc3c2[nH]1