InChI In Action In Aachen - 24-25 July 2024 (June 6, 2024)
Technical meeting, focussing on organometallics, inorganics, stereochemistry and
programming issues.
Day 1 pm only
General overview / status overview
Testing & GitHub
Group reporting: RInChI, Stereochem, Polymers, Inorganics
Directions of InChI
Compression/Hashing of InChI string
• Pain points/gaps of InChI
• InChI and legislation
• Potential opportunities in industry
Day 2
Inorganics prototype, inorganic stereochemistry, enhanced (organic) stereochemistry (am)
• Feedback on actual status of inorganics prototype
• Discussion: status of planned inorganic stereochemistry enhancements
• Discussion: status of planned “enhanced stereochemistry”
• Changes of the InChI format related to inorganics/organometallic enhancements and enhanced stereochemistry, need for additional stereochemistry layers
Architecture of InChI: MInChi, NInChI, RInChI (pm)
• Shared code stream?
• Common data input format? Adapted UDM format
• Application InChI deliveries
• Test environments and test data
