- Update pydantic version
- Rename deprecated
affinity
keyword in clustering tometric
. - Update pytorch-lightning version to >=1.6.0 and <1.8.4
- Update Python version to >=3.9 and <3.11
- Use RDKit from pypi
- Update dependency versions
- Use newer versions of PyTorch lightning, Sphinx and Black
- Remove deprecated use of Pandas append function
- Generalization of featurization for TED calculations
- Utility routines for route property calculations
- Removed usage of deprecated pytorch-lightning routines
- Pin pytorch-lightning to less than 1.5.0
- Support for ML-based model to predict distances between routes
- First version