Interactive example of the 3d directional convex hull using chemiscope widget

scikit-learn-contrib / scikit-matter

A collection of scikit-learn compatible utilities that implement methods born out of the materials science and chemistry communities

https://scikit-matter.readthedocs.io/en/v0.2.0/

BSD 3-Clause "New" or "Revised" License

76 stars 20 forks source link

Interactive example of the 3d directional convex hull using chemiscope widget #169

Closed agoscinski closed 1 year ago

agoscinski commented 1 year ago

https://github.com/lab-cosmo/scikit-matter/blob/paper-ore/paper/ice_convex_hull.ipynb

agoscinski commented 1 year ago

We don't want unnecessary external dependencies for the examples on chemiscope. We have now an example not using chemiscope. So open part of the issue is moved to the software cookbook https://github.com/lab-cosmo/software-cookbook/issues/10