3
Candidates
{"P": 1, "N": 5}
Ground Truth
{"P": 3, "N": 5}
Top-1 Prediction
0.750
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
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.00
[Ru+2]<-[n]1ccc[nH]1
#1
TOP-1
0.99 ± 0.01
[Ru+2]<-[P](c1ccccc1)(c1ccccc1)c1ccccc1
#1
TOP-1
0.34 ± 0.44
c1ccc([P](->[Ru+2]<-[n]2ccc[nH]2)(c2ccccc2)c2ccccc2)cc1
#1
TOP-1
0.44 ± 0.36
c1ccc([P](c2ccccc2)(c2ccccc2)->[Ru+2]23(<-[n]4ccc[nH]4)<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)cc1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.30 ± 0.00
c1c[nH][n](->[Ru+2]23<-[n]4cccn4C(n4ccc[n]->24)n2ccc[n]->32)c1
#2
0.00 ± 0.00
c1ccc(P(c2ccccc2)c2ccc[cH]3->[Ru+2]<-[cH]23)cc1
#2
0.00 ± 0.00
c1ccc([P](->[Ru+2]<-[cH]2cn[nH]c2)(c2ccccc2)c2ccccc2)cc1
#2
0.04 ± 0.09
c1ccc([P](c2ccccc2)(c2ccccc2)->[Ru+2]2(<-[n]3ccc[nH]3)<-[n]3cccn3C(n3cccn3)n3ccc[n]->23)cc1
#3
0.16 ± 0.00
c1ccc([P](->[Ru+2]<-[n]2ccc[nH]2)(c2ccccc2)c2ccccc2)cc1
#3
0.16 ± 0.00
c1ccc([P](->[Ru+2]<-[n]2ccc[nH]2)(c2ccccc2)c2ccccc2)cc1
#3
0.16 ± 0.00
c1ccc([P](->[Ru+2]<-[n]2ccc[nH]2)(c2ccccc2)c2ccccc2)cc1
#3
0.16 ± 0.00
c1ccc([P](->[Ru+2]<-[n]2ccc[nH]2)(c2ccccc2)c2ccccc2)cc1
#3
0.16 ± 0.00
c1ccc([P](->[Ru+2]<-[n]2ccc[nH]2)(c2ccccc2)c2ccccc2)cc1
#3
0.16 ± 0.00
c1ccc([P](->[Ru+2]<-[n]2ccc[nH]2)(c2ccccc2)c2ccccc2)cc1