Downloading

All of Binding MOAD

The number of biounits has gotten very large so we have split them into two files (every_part_a.zip and every_part_b.zip), please download both files to get the complete set.

Biounits (part_a)
Biounits (part_b)
Binding data

(only those w/ binding data)
Biounits
Binding data
Non-redundant MOAD

(leaders only)
Biounits
Binding data

(only those w/ binding data)
Biounits
Binding data
Only the new 2014 data
Biounits
Binding data
HiQ set (Subset of structures setup for docking and scoring.)
Reference: CSAR Benchmark Exercise of 2010: Selection of the Protein-Lgand Complexes. James B. Dunbar, Jr., Richard D. Smith, Chao-Yie Yang, Peter Man-Un Ung, Katrina W. Lexa, Nickolay A. Khazanov, Jeanne A. Stuckey, Shaomeng Wang, and Heather A. Carlson. (2011) Journal of Chemical Information and Modeling. 51 (9), 2036-2046
CSAR-NRC HiQ set
CSAR-NRC HiQ Update
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