JacksonBurns/fastsolv
fastsolv python package, website, and paper code
Predicting how soluble a solid compound will be in a solvent is a crucial step in drug discovery and materials science. This tool takes the chemical structures of a solid compound and a solvent as input and provides a prediction of the solid's solubility. It's designed for chemists, pharmaceutical scientists, and materials engineers who need quick and accurate solubility estimates.
No commits in the last 6 months. Available on PyPI.
Use this if you need to rapidly assess the solubility of a new chemical compound in various solvents without conducting time-consuming lab experiments.
Not ideal if you require experimental validation or extremely high-precision solubility measurements for regulatory submissions or final product development.
Stars
40
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6
Language
Jupyter Notebook
License
MIT
Category
Last pushed
Aug 27, 2025
Commits (30d)
0
Dependencies
4
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