Active site configurations at the PS in different QM/MM simulations.
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https://figshare.com/articles/dataset/_Active_site_configurations_at_the_PS_in_different_QM_MM_simulations_/173218
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Details of simulations 1, 4–8, 10–13 are provided in Text S1 and FiguresS1, S2, S3, S4, S5.aThe RS structure in this simulation does not correspond to a known antibiotic.
创建时间：
2015-12-02
