Related Issues (20)
- hdbscan temporarily not working HOT 1
- Issue with custom color for pareto_plot (can't use strings for color values)
- peak_score.csv should probably have `k_neigh_avg` instead of `density`
- Readthedocs not creating mat_discover_ docs
- Error while using `nearest_neigh_prop` HOT 3
- Density scores are negative if property values are negative (?)
- LLVM error on CPU HOT 15
- Support Python 3.10
- Remove `flit_core >=3.2,<4` in meta.yaml produced by run_grayskull.py
- megnet not installed, how to deal with crystal vs. composition dependencies?
- why was jaxlib incompatible?
- GitHub actions: make sure that workflow recognizes the error of "already uploaded to PyPI" and stops there
- Add/improve docstrings for `Adapt` class
- add `skip_write_image` kwarg
- add unique elements and unique templates from extraordinary as measure of both performance + novelty
- Additional performance/novelty metric
- Compare with Bayesian optimization
- Aitchison compositional distance metric as a swap-out for element mover's distance
- FileNotFoundError while splitting val_df into chunks HOT 2
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