homecomplexesD-MPNN

D-MPNN Donor Prediction

Sequential multi-lig (7058) — 7058 complexes
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)⇄ Compare
87
Exact (1.0)
2026
Partial (>0)
4945
No match
0.159
Mean score
Reset
#1935 4 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1936 5 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1937 6 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1938 8 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1939 9 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1940 10 Ru(2) — 2 candidates
GT: {"N": 4} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1943 TM102,Ru complex Ru(2) — 3 candidates
GT: {"N": 2, "P": 1} Pred: {"N": 6, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1944 Complex 2 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"O": 2, "N": 2, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1945 Complex 4 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"N": 2, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1946 Complex 5 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"N": 2, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1947 Complex 6 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"N": 2, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1948 Complex 7 Ru(2) — 3 candidates
GT: {"N": 1, "P": 1} Pred: {"O": 2, "N": 2, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1949 C1 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1950 C2 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1951 C3 Ru(2) — 2 candidates
GT: {"O": 1, "N": 1} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1952 C4 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1953 C5 Ru(2) — 2 candidates
GT: {"N": 1, "O": 1} Pred: {"N": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1954 Ru–1 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
#1955 Ru–2 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#1956 Ru–3 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 15}
0.00
Candidates → Complex detail MOL 3D Viewer
#1963 2 Ru(2) — 3 candidates
GT: {"N": 6} Pred: {"N": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#1967 Ru1 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#1968 Ru2 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 8}
0.00
Candidates → Complex detail MOL 3D Viewer
#1969 Ru3 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 10}
0.00
Candidates → Complex detail MOL 3D Viewer
#1970 Ru4 Ru(2) — 3 candidates
GT: {"N": 7} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#1972 RDC56,7a Ru(2) — 3 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#1975 1 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1976 2 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"O": 1, "N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1977 3 Ru(2) — 2 candidates
GT: {"N": 2} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#1978 Complex 1 Ru(2) — 0 candidates
GT: {"O": 2, "N": 3, "P": 2} Pred: {}
0.00
Candidates → Complex detail MOL 3D Viewer
#1980 RDC40,4e Ru(2) — 3 candidates
GT: {"O": 1, "N": 5} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
#1982 1 Ru(2) — 0 candidates
GT: {"O": 1, "N": 2, "P": 1} Pred: {}
0.00
Candidates → Complex detail MOL 3D Viewer
#1983 2 Ru(2) — 0 candidates
GT: {"O": 1, "N": 2, "As": 1} Pred: {}
0.00
Candidates → Complex detail MOL 3D Viewer
#1987 2 Ru(2) — 2 candidates
GT: {"P": 1, "N": 1} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1988 3 Ru(2) — 2 candidates
GT: {"N": 4, "P": 1} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1994 2a Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1995 2b Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1996 3a Ru(2) — 2 candidates
GT: {"N": 3} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#1997 1 Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2004 1 Ru(2) — 3 candidates
GT: {"S": 1, "N": 4, "P": 2} Pred: {"S": 3, "N": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#2008 1a Ru(2) — 3 candidates
GT: {"O": 1, "N": 2, "P": 1} Pred: {"O": 3, "N": 1, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2009 2a Ru(2) — 3 candidates
GT: {"O": 1, "N": 2, "P": 1} Pred: {"O": 6, "N": 1, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2010 3a Ru(2) — 3 candidates
GT: {"N": 2, "P": 1, "O": 1} Pred: {"N": 2, "P": 2, "O": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#2011 2b Ru(2) — 3 candidates
GT: {"O": 1, "P": 1, "N": 1} Pred: {"O": 6, "N": 1, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2012 3b Ru(2) — 3 candidates
GT: {"O": 1, "P": 1, "N": 1} Pred: {"O": 4, "P": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#2015 1 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2016 2 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2017 3 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2018 4 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#2019 5 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
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