3
Candidates
{"N": 6}
Ground Truth
{"N": 15}
Top-1 Prediction
0.400
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
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.15 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1c4[n]2->[Ru+2]<-[n]1nc2-c1cnccn1
#1
TOP-1
0.94 ± 0.04
c1cc2ccc3cccc4c5n[n]6->[Ru+2]<-[n]7ccncc7-c6nc5c(c1)c2c34
#1
TOP-1
0.27 ± 0.41
c1cc[n]2->[Ru+2]3(<-[n]4ccccc4-c2c1)<-[n]1ccncc1-c1nc2c4cccc5ccc6cccc(c2n[n]->31)c6c54
#1
TOP-1
0.21 ± 0.44
c1cc[n]2->[Ru+2]34(<-[n]5ccccc5-c2c1)(<-[n]1ccccc1-c1cccc[n]->31)<-[n]1ccncc1-c1nc2c3cccc5ccc6cccc(c...
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.08 ± 0.00
c1cc[n]2->[Ru+2](<-[n]3ccccc3-c2c1)<-[n]1nc2c3cccc4ccc5cccc(c2nc1-c1cnccn1)c5c43
#2
0.31 ± 0.29
[Ru+2]<-[n]1ccnc(-c2nnc3c4cccc5ccc6cccc(c3n2)c6c54)c1
#2
0.00 ± 0.00
C1=NC(c2ccccn2)=C[CH]2[CH]1[Ru+2]21<-[n]2ccncc2-c2nc3c4cccc5ccc6cccc(c3n[n]->12)c6c54
#2
0.03 ± 0.07
c1ccc(-c2nc[cH]3->[Ru+]456(<-[cH]2[cH]->43)(<-[n]2ccccc2-c2cccc[n]->52)<-[n]2ccncc2-c2nc3c4cccc5ccc7...
#3
0.00 ± 0.00
c1cc[n]2->[Ru+2]3(<-[n]4ccncc4-c4nnc5c6cccc7ccc8cccc(c5n4)c8c76)(<-[n]4ccccc4-c2c1)<-[n]1ccccc1-c1cc...
#3
0.00 ± 0.00
c1cc[n]2->[Ru+2]3(<-[n]4ccncc4-c4nnc5c6cccc7ccc8cccc(c5n4)c8c76)(<-[n]4ccccc4-c2c1)<-[n]1ccccc1-c1cc...
#3
0.00 ± 0.00
c1cc[n]2->[Ru+2]3(<-[n]4ccncc4-c4nnc5c6cccc7ccc8cccc(c5n4)c8c76)(<-[n]4ccccc4-c2c1)<-[n]1ccccc1-c1cc...
#3
0.00 ± 0.00
c1cc[n]2->[Ru+2]3(<-[n]4ccncc4-c4nnc5c6cccc7ccc8cccc(c5n4)c8c76)(<-[n]4ccccc4-c2c1)<-[n]1ccccc1-c1cc...
#3
0.00 ± 0.00
c1cc[n]2->[Ru+2]3(<-[n]4ccncc4-c4nnc5c6cccc7ccc8cccc(c5n4)c8c76)(<-[n]4ccccc4-c2c1)<-[n]1ccccc1-c1cc...
#3
0.00 ± 0.00
c1cc[n]2->[Ru+2]3(<-[n]4ccncc4-c4nnc5c6cccc7ccc8cccc(c5n4)c8c76)(<-[n]4ccccc4-c2c1)<-[n]1ccccc1-c1cc...