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Mar 1, 2024 -
Supporting Information: Notebooks, Solute Configurations and Solvation Free Energy Data
Jupyter Notebook - 17.9 KB -
MD5: d6ea8c0acd6f60f6fa017fb768e99019
Jupyter notebook for calculating solvation free energies. |
Mar 1, 2024 -
Supporting Information: Notebooks, Solute Configurations and Solvation Free Energy Data
Jupyter Notebook - 1.2 MB -
MD5: d014dee19d93c0e10f86134138e475cb
Jupyter notebook for recreating all figures of the publication. |