- Major modifications to adsorbates fingerprinter
- Bag of site neighbor coordinations numbers implemented.
- Bag of connections implemented for adsorbate systems.
- General bag of connections implemented.
- Data cleaning function now return a dictionary with 'index' of clean features.
- New clean function to discard features with excessive skewness.
- New adsorbate-chalcogenide fingerprint generator.
- Enhancements to automatic identification of adsorbate, site.
- Generalized coordination number for site.
- Formal charges utility.
- New sum electronegativity over bonds fingerprinter.