GNINA

GNINA dataset for molecular docking, used for benchmarking docking methods.

Data and Resources

Cite this as

Rishal Aggarwal, Henry Dieckhaus, James Wellnitz, Josh Hochuli, Kathryn Kirchoff, Travis Maxfield (2024). Dataset: GNINA. https://doi.org/10.57702/bdie1lrd

DOI retrieved: December 2, 2024

Additional Info

Field Value
Created December 2, 2024
Last update December 2, 2024
Defined In https://doi.org/10.48550/arXiv.2307.12090
Author Rishal Aggarwal
More Authors
Henry Dieckhaus
James Wellnitz
Josh Hochuli
Kathryn Kirchoff
Travis Maxfield
Homepage https://github.com/molecularmodelinglab/gnina