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Three-Dimensional Biologically Relevant Spectrum (BRS-3D)

The crystallized ligands in the Protein Data Bank(PDB)can be treated as the inverse shapes of the active sites of corresponding proteins.

Therefore, the shape similarity between a molecule and PDB ligands indicated the possibility of the molecule to bind with the targets.


Method of BRS-3D Construction

Here is some key functions our webservice provided.

Kong's Lab
Chemoinformatics and Drug Design Lab.
Collage of Informatics.
Huazhong Agricultural University.
#1 Shizishan St., Hongshan Dist.
Wuhan, Hubei Province.
P.R. of China

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