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README.md

Doge420

After releasing v1 of Curie-Web, Lord Shibe decided in-browser processing was the way to go.

What Works?

  • Fetching SMILES from PubChem by Name
  • Generating Image
  • Calculating Properties
  • Generating AutoDock PDBQTs

What will work one day? (Read: Planned Features with 100% success rate)

  • Substructure Flagging: Highlighting potential flaws in structure
  • Classification Models: Like SwissDock but in-browser
  • In-Browser Docking using webina (Waiting for WebAssembly Threads to go mainstream again )

Dreams

  • Retrosynthesis Planning
  • Find Papers (Like inciteful.xyz)

Modules

  • RDKitJS
  • OpenBabelJS

Installing

????? It is just plain ol' HTML+JS+CSS in the docs folder