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InChI Working Groups Meeting
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How are the diverse working groups for InChI development progressing? This virtual meeting is an opportunity for the working groups to report on their activities and to consult a wider group on the challenges and choices they are facing. The meeting will culminate in an on-line plenary session on Monday 26th April, from 7 pm to 9 pm, UK time.
- Monday April 26th, 7 pm (UK), 2 pm (ECT), 9 pm (Moscow), 6 am +1 day (NZ)
- Plenary Session
- Slides from the plenary session
- IUPAC InChI Subcommittee Secretary:
- Jonathan Goodman (jonathan@inchi-trust.org)
- Wednesday April 7th
- NanoInChI (Iseult Lynch)
- Can an InChI for Nano Address the Need for a Simplified Representation of Complex Nanomaterials across Experimental and Nanoinformatics Studies?
- Monday April 12th
- Variable InChI (Markush/VInChI) (Jonathan Goodman)
- InChI: Variable Structures and Markush
- Friday April 16th
- Open Educational Resources (Bob Belford)
- InChI Trust Open Education Resource
- Monday April 19th
- Reaction InChI (RInChI) (Gerd Blanke)
- International chemical identifier for reactions (RInChI)
- Monday April 19th, 6 pm (UK), 1 pm (EDT), 2 am (Japan)
- Organometallic InChI (Colin Batchelor)
- Tuesday April 20th
- Mixture InChI (MInChI) (Leah McEwen)
- Capturing mixture composition: an open machine-readable format for representing mixed substances
- https://github.com/IUPAC/MInChI
- Wednesday April 21st
- Extended Stereochemistry (Andrey Erin)
- Wednesday April 21st
- InChI Resolver (Markus Sitzmann)
- github.com/inchiresolver
- Thursday April 22nd
- Large Molecules (Evan Bolton)
- Thursday April 22nd
- QR codes for InChI (Jeremy Frey / Richard Hartshorn)
- Experimental, proof-of-concept, QRInChI generator
- Friday April 23rd, 5 pm (UK); 12 noon (EDT), 1 am (Japan)
- Tautomers (Marc Nicklaus)
- Talk from NIH meeting, March 2021
Working groups have also reported at a recent NIH meeting:
Virtual Workshop on International Chemical Identifiers (InChI)
March 22nd – 24th, 2021
Organisers: Steve Heller, Marc Nicklaus, Evan Bolton and Noel Southall
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