xlm.tasks.safe_molgen

Public entry point for SAFE / molecular generation task code.

Implementation lives in :mod:~xlm.tasks._safe_molgen_impl and loads on first use (attributes other than ZINC_LENGTH_REF_FILE trigger the import).

Optional CHEMISTRY install::

pip install "xlm-core[safe]"

For the fuller GenMol / Biomemo / OpenBabel stack (see requirements/molgen_requirements.txt)::

pip install "xlm-core[molgen]"