v1.0.1

Minor release containing improved documentation and updates for gufe abc updates.

What's Changed

• Docs by @RiesBen in #27
• Update index.rst by @RiesBen in #28
• Update Install Instructions + May Other Fixes by @mikemhenry in #29
• include date in cache key by @mikemhenry in #31
• Add deps to colab notebook by @mikemhenry in #32
• Make Mapper tokenizable by @richardjgowers in #33

Full Changelog: 1.0.0...v1.0.1

Kartograf v1.0.0

🥳 Kartograf is now at v1.0.0 🥳
Features:

• Mapping Geometry Based Atom Mapper
  • Fitlers for applying rules what not to map (ring breaks or ring size changes, element changes, no hydrogens, etc.)
• SmallCompound alignment tools - MCS or shape based
• Mapping Scoring Metrics (and an experimental Scorer - don't use for real business)
• visualization widget for multiple mappings in jupyter notebooks

Looking forward to get your Feedback! 😁

Minor Updates

• minor refactor
• adding new optional visualization