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A Python package for interactive mapping and geospatial analysis with minimal coding in a Jupyter environment

  • ipyleaflet
  • folium
  • mapping
  • python

Multi-stage Riemannian flow matching for physically valid molecular docking, with GNINA scoring, PoseBusters filtering, CLI inference, and benchmarks.

  • alphafold3
  • docking
  • drug-design
  • drug-discovery