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Benchmarking AlphaFold-enabled molecular docking predictions for antibiotic discovery


ABSTRACT: This dataset contains enzymatic inhibition results for 12 essential E. coli proteins and 218 active antibacterial compounds, and serves as a benchmarking dataset to evaluate antibiotic-protein interactions.

ORGANISM(S): Escherichia coli

SUBMITTER:  

PROVIDER: S-BSST863 | biostudies-other |

REPOSITORIES: biostudies-other

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