3
Candidates
{"N": 6}
Ground Truth
{"N": 9}
Top-1 Prediction
0.000
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
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.10 ± 0.00
c1cc2ccc3cccc4c3c2c(c1)c1nnc2-c3cncc[n]3->[Ru+2]<-[n]2c41
#1
TOP-1
0.94 ± 0.04
c1cc2ccc3cccc4c5n[n]6->[Ru+2]<-[n]7ccncc7-c6nc5c(c1)c2c34
#1
TOP-1
0.21 ± 0.41
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccncc5-c5nc6c7cccc8ccc9cccc(c6n[n]->45)c9c87)<-[n]4ccc(-c5ccccc5)c5cc...
#1
TOP-1
0.20 ± 0.44
c1ccc(-c2cc[n]3->[Ru+2]45(<-[n]6ccncc6-c6nc7c8cccc9ccc%10cccc(c7n[n]->46)c%10c98)(<-[n]4ccc(-c6ccccc...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.04 ± 0.00
c1ccc(-c2cc[n]3->[Ru+2]4(<-[n]5ccc(-c6ccccc6)c6ccc2c3c65)<-[n]2ccc(-c3ccccc3)c3ccc5c(-c6ccccc6)cc[n]...
#2
0.31 ± 0.29
[Ru+2]<-[n]1ccnc(-c2nnc3c4cccc5ccc6cccc(c3n2)c6c54)c1
#2
0.13 ± 0.27
C1=C(c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)[CH]2[CH]3[CH]4[CH]1[Ru+2]2431<-[n]2ccncc2-c2nc3c4cccc5ccc6cccc...
#2
0.13 ± 0.17
C1=C[CH]2[CH](C(c3ccnc4c3ccc3c(-c5ccccc5)ccnc34)=C1)[Ru+2]213(<-[n]2ccncc2-c2nc4c5cccc6ccc7cccc(c4n[...
#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