Supporting Information: Notebooks, Solute Configurations and Solvation Free E...
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https://b2find.eudat.eu/dataset/b973cffa-67f5-5757-8c56-3ca91fcda912
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资源简介：
This dataset contains three types of data: 1) Jupyter notebooks (.ipynb) for the calculation of solvation free energies and for the recreation of all figures in the publication;...
