A practical web application for the recommendation of organic solvents based on the paper Solvmate - A hybrid physical/ML approach to solvent recommendation leveraging a rank-based problem framework (https://chemrxiv.org/engage/chemrxiv/article-details/662f451f418a5379b0012795).
Given a compound as SMILES, and set of solvents as IUPAC names, the solvents are recommended in increasing solubility.
The following animation shows a simple step-by-step guide (domain not active (yet)):
The default credentials are user: "user", password: "solvmate"
Have a look in the auth.py module how additional users can be configured.
We thank F. Broda from Leibniz-Institut f. Pflanzenbiochemie for the development of MolPaintJS, a FOSS molecule editor that we use for the convenient input of molecules.