Stereocontrol on Helical Bimetallic DNA Catalysts with Switchable Enantioselectivity via Dynamic Reaction Distance Regulation

This folder contains the GFN2-xTB-optimized geometries (in .xyz format) for the paper entitled ”Helical Bimetallic DNA Catalysts Enable A New Mode of Stereocontrol with Switchable Enantioselectivity“. The file naming is consistent with that in the supporting information. The data are organised in the following folders: /adjacent/ -- GFN2-xTB-optimized geometries for the study of adjacent DNA model system /intervening/ -- GFN2-xTB-optimized geometries for the study of intervening DNA model system /two_dna_system/ -- GFN2-xTB-optimized geometry for the study of two-DNA system