superstar54 / weas-widget

A widget to visualize and edit atomic structures in Jupyter Notebook

Home Page:https://weas-widget.readthedocs.io/en/latest/index.html

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New Features List

superstar54 opened this issue · comments

Here, I list the features that are considered to be added in the future.

Features must have

  • display as a HTML file
  • add text
  • high order bond

Features nice to have

  • isosurface cap to seal the surface on the boundary.
  • molecular surface
  • show cavity for porous materials
  • export 3D model, e.g., obj format
  • show fixed atoms
  • hydrogen bond
  • bond setting

Please feel free to suggest any additional features you would like to see implemented.