3
Candidates
{"O": 1, "N": 4}
Ground Truth
{"O": 6, "N": 5}
Top-1 Prediction
0.455
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
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.91 ± 0.00
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.89 ± 0.13
Oc1cc2[O][Ru+]<-[O]=c3cc(-c4ccccc4)oc(c1)c23
#1
TOP-1
0.57 ± 0.43
Oc1cc2[O][Ru+]3(<-[O]=c4cc(-c5ccccc5)oc(c1)c24)<-[n]1ccc(-c2ccccc2)c2ccc4c(-c5ccccc5)cc[n]->3c4c21
#1
TOP-1
0.41 ± 0.52
Oc1cc2[O][Ru+]34(<-[O]=c5cc(-c6ccccc6)oc(c1)c25)(<-[n]1ccc(-c2ccccc2)c2ccc5c(-c6ccccc6)cc[n]->3c5c21...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.18 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.31 ± 0.22
O=c1cc(-c2ccccc2)oc2cc(O)cc([O][Ru+])c12
#2
0.20 ± 0.44
Oc1cc2[O][Ru+]34567(<-[O]=c8cc(-c9ccccc9)oc(c1)c28)<-[cH]1[cH]->3[cH]->4[c]->5(-c2ccnc3c2ccc2c(-c4cc...
#2
0.26 ± 0.39
Oc1cc2[O][Ru+]3(<-[O]=c4cc(-c5ccccc5)oc(c1)c24)(<-[n]1ccc(-c2ccccc2)c2ccc4c(-c5ccccc5)ccnc4c21)<-[n]...
#3
0.02 ± 0.00
[Ru+2]<-[n]1ccc(-c2ccccc2)c2ccc3c(-c4ccccc4)ccnc3c21
#3
0.02 ± 0.00
[Ru+2]<-[n]1ccc(-c2ccccc2)c2ccc3c(-c4ccccc4)ccnc3c21
#3
0.02 ± 0.00
[Ru+2]<-[n]1ccc(-c2ccccc2)c2ccc3c(-c4ccccc4)ccnc3c21
#3
0.02 ± 0.00
[Ru+2]<-[n]1ccc(-c2ccccc2)c2ccc3c(-c4ccccc4)ccnc3c21
#3
0.02 ± 0.00
[Ru+2]<-[n]1ccc(-c2ccccc2)c2ccc3c(-c4ccccc4)ccnc3c21
#3
0.02 ± 0.00
[Ru+2]<-[n]1ccc(-c2ccccc2)c2ccc3c(-c4ccccc4)ccnc3c21