Replication Data of Kästner group for: "Determination of Accessibility and Sp...
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https://b2find.eudat.eu/dataset/efcd36ab-7ad9-5f85-9b3b-1c4e8a18abb4
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In this dataset, all simulation data are listed. That includes all geometry optimizations and single-point calculations and the conformational sampling. Furthermore, the...
