A transient third metal ion shapes the catalytic cycle of a group I intron ribozyme
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Source data for Figures 2-5 and Tables 2-5 of the associated manuscript.Source data for replication of PBSA calculations, 1D-RISM calculations, 3D-RISM calculations, MD simulations, ABFE simulations, QM/MM+ΔMLP training, and QM/MM+ΔMLP simulations. See 0README files within each folder for more information.
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Zenodo创建时间：
2026-07-09
