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AmpC_screen_table.csv.gz (1.56 GB)

AmpC_screen_table.csv.gz

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Version 2 2018-11-21, 05:46
Version 1 2018-11-20, 01:19
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posted on 2018-11-21, 05:46 authored by Trent BaliusTrent Balius, Jiankun LyuJiankun Lyu, Brian K. Shoichet, John J. Irwin
Comma separated values with zincid, smiles, dock score (kcal/mol) for a docking calculation against the AmpC beta-lactamase. To be published in nature: Lyu et. al.

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    Docking StudiesComputational ChemistryBiomolecular Modelling and Design

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    CC BY 4.0

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