It would be nice to relax the version dependencies in the
pyproject.toml but fixing them in the
The main issue if we fix all the versions in
Practically it is impossible to install
nomad-labpackage into an existing python environment eg using a jupyter docker image...
- it doesn't make sense to uninstall and reinstall different version of numpy pandas just because you want to do a query...
--no-dependenciesto ignore package dependencies but then it is hard to install the necessary packages manually...
Obviously it is the easy way to setup an python environment from scratch but for that purpose you can use the