/gpHSP

Code to build a probabilistic predictive model for HSP

Primary LanguageJupyter NotebookMIT LicenseMIT

Gaussian Processes Hansen Solubility Parameters (gpHSP)

Code repo for gpHSP

Want to predict a probabilisitc model for solublity? Have low amounts of data?

.. then maybe gpHSP is the right tool for you.

Todo

  • Make end-to-end example.
  • Make cheaper alternative models (e.g. smiles to HSP).
  • Release gpmol dependency.