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MolecularAI / QSARtuna

QSARtuna: QSAR model building with the optuna framework
https://molecularai.github.io/QSARtuna/
Apache License 2.0
102 stars 16 forks source link

Install instruction on conda has link to AZ server failing #2

Closed jeremycheminf closed 8 months ago

jeremycheminf commented 8 months ago

The installation to run the tool with a notebook has this line python -m pip install http://pages.scp.astrazeneca.net/mai/qptuna/releases/Qptuna_latest.tar.gz but when running it, it gives error to access the file

WoutVanEynde commented 8 months ago

Have you resolved this problem?

jeremycheminf commented 8 months ago

Hi I managed via cloning the repo and then run poetry install 👍

WoutVanEynde commented 8 months ago

Alright, thank you!

lewismervin1 commented 8 months ago

Thanks for the issue. I have created a new release 3.0.0.1 with QSARtuna renaming, which in the release notes has the tar.gz for the pip install. I have updated the README with the new command which is python -m pip install https://github.com/MolecularAI/QSARtuna/files/14742594/qsartuna-3.0.0.1.tar.gz