PSnpBind

Other names: psnpbind

PSnpBind is a large database of protein–ligand complexes covering a wide range of binding pocket mutations and small molecules’ landscape. This database can be used as a source of data for different types of studies, for example, developing machine learning algorithms to predict protein–ligand affinity or mutation's effect on it which requires an extensive amount of data with a wide coverage of mutation types and small molecules. Also, studies of protein-ligand interactions and conformer orientation changes across different mutated versions of a protein can be established using data from PSnpBind.

Webpage:
https://psnpbind.org

Licence:
Name: CC
URL: https://creativecommons.org/licenses/by/4.0/

Publications:

Tags:

autodock vina binding affinity binding pocket mutation effect virtual screening dna polymorphism molecular modelling small molecule workflows nmr

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