Data files
What is a Data file?A collection of python scripts used to generate CML from csv (CSV_to_CML.py), apply machine learning (Gradient Boosting using decision trees, prediction_viscosity.py), model based on eq 6 in the associated publication, and to plot the generated data (plot*.py).
Creators: Gudrun Gygli, Xinmeng Xu, Juergen Pleiss
Submitters: Gudrun Gygli, Xinmeng Xu
Contains CML dictionaries created to store deep eutectic solvent data with CML.
Contains CML created for experimental, simulation and predicted data. Predictions were made based on experimental data using a gradient boosting decision tree.
Creators: Gudrun Gygli, Xinmeng Xu, Juergen Pleiss
Submitters: Gudrun Gygli, Xinmeng Xu