Published January 11, 2023
| Version v1
Dataset
Open
Data for Structural Features of Interfacial Water Predict the Hydrophobicity of Chemically Heterogeneous Surfaces
Description
Scripts, raw and processed data, Jupyter notebooks, and force field files for the simulations performed in:
B. C. Dallin, A. S. Kelkar, and R. C. Van Lehn. “Structural Features of Interfacial Water Predict the Hydrophobicity of Chemically Heterogeneous Surfaces.” Chemical Science 2023.
Notes
Files
Files
(661.0 MB)
Name | Size | Download all |
---|---|---|
md5:51e16b6f5aab3924dbe641f588b03405
|
661.0 MB | Download |