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#inchi — Public Fediverse posts

Live and recent posts from across the Fediverse tagged #inchi, aggregated by home.social.

  1. Yesterday, we were very happy to host the November meeting of the InChI developer team at the Beilstein-Institut. Many thanks to the Aachen side of the InChI team for coming to Frankfurt!

    Find out more about our #BeilsteinCheminfoLabs projects where we are supporting InChI and other open source projects ➡️ beilstein-institut.de/en/proje

    #inchi #cheminformatics #chemistrystandards #iupacinchi

  2. Yesterday, we were very happy to host the November meeting of the InChI developer team at the Beilstein-Institut. Many thanks to the Aachen side of the InChI team for coming to Frankfurt!

    Find out more about our #BeilsteinCheminfoLabs projects where we are supporting InChI and other open source projects ➡️ beilstein-institut.de/en/proje

    #inchi #cheminformatics #chemistrystandards #iupacinchi

  3. Yesterday, we were very happy to host the November meeting of the InChI developer team at the Beilstein-Institut. Many thanks to the Aachen side of the InChI team for coming to Frankfurt!

    Find out more about our #BeilsteinCheminfoLabs projects where we are supporting InChI and other open source projects ➡️ beilstein-institut.de/en/proje

    #inchi #cheminformatics #chemistrystandards #iupacinchi

  4. Yesterday, we were very happy to host the November meeting of the InChI developer team at the Beilstein-Institut. Many thanks to the Aachen side of the InChI team for coming to Frankfurt!

    Find out more about our #BeilsteinCheminfoLabs projects where we are supporting InChI and other open source projects ➡️ beilstein-institut.de/en/proje

    #inchi #cheminformatics #chemistrystandards #iupacinchi

  5. Yesterday, we were very happy to host the November meeting of the InChI developer team at the Beilstein-Institut. Many thanks to the Aachen side of the InChI team for coming to Frankfurt!

    Find out more about our #BeilsteinCheminfoLabs projects where we are supporting InChI and other open source projects ➡️ beilstein-institut.de/en/proje

    #inchi #cheminformatics #chemistrystandards #iupacinchi

  6. #WorldStandardsDaytoday

    Our contribution:
    - developing #ontologies for #chemistry,⠀
    - helping on the development of the #INChI
    - provide a #terminology service⠀
    - and we create MICHIs.
    #NMR #MICHI is finished, now asking for feedback in the adoption of the U-Vis MICHI.⠀⠀
    t1p.de/ljeii⠀

  7. InChI is one of the most important identifiers in #chemistry – and identifiers are important for making chemical data machine-readable and thus FAIR.

    It is therefore important to maintain and further develop this #identifier.

    Read our report on the latest #InChI #meeting

    nfdi4chem.de/shaping-the-futur

  8. InChI is one of the most important identifiers in #chemistry – and identifiers are important for making chemical data machine-readable and thus FAIR.

    It is therefore important to maintain and further develop this #identifier.

    Read our report on the latest #InChI #meeting

    nfdi4chem.de/shaping-the-futur

  9. @schymane yes, I agree. I also filed a feature request to have the official test cases easily reused by other software. that should also provide #inchi examples

  10. Day 2 of the #InChI Technical Meeting @rwth.bsky.social in Aachen focused on inorganic stereochemistry & Polymer-InChI development. Thanks to @volkswagenstiftung.de @nfdi4chem.de and @beilsteininstitut.hessen.social.ap.brid.gy for funding! Next-gen cheminformatics is taking shape! #OpenScience

  11. ha, I managed to convert a CXSMILES in @wikidata via the MDL V2000 molfile and the #inchi webtool into an #InChI (!B) and InChIKey :) wikidata.org/wiki/Q66421202#P1

    #cheminformatics #polymers

  12. heading to the 2nd day of the Technical InChI Meeting in Aachen/Germany

    #cheminformatics #inchi

  13. okay, updated NanoJava to JUnit5 so that it now also compiles with Java21. I made a release. Time to update (py)Bacting and see if I can hack in nano #inchi calculation from the command line doi.org/10.5281/zenodo.1625758

  14. * nanoJava update: check
    * ERM database update: check (no nano InChI yet)
    * #inchi fediwall: check -> egonw.github.io/INOSC/?tags=in

  15. heading tomorrow to the InChI Technical Exchange Meeting Summer 2025 in Aachen/DE

    Looking forward to it, and particularly talking about the InChI for inorganics and trying that in @wikidata :) See doi.org/10.26434/chemrxiv-2025

    And also the nano InChI, see doi.org/10.3390/nano10122493

    #nanoinformatics #cheminformatics #inchi #wikidata #chemistry

  16. @BeilsteinInstitut So excited about this release! And here's our first article with #InChI #SMILES embedded

  17. We streamline the discoverability of published research by incorporating machine-readable chemical information. This enables #FAIRdata - without extra effort from the authors, and of course, at no charge to authors or readers.

    🔗 beilstein-journals.org/bjoc/ne

    #InChI #openscience #PubChem

  18. another speaker is confirmed:

    - Prof dr Sonja Herres-Pawlis (RWTH Aachen University): “News from the InChI: making the InChI FAIR and including inorganics”

    The CDK has had InChI support for many years and recently gained Reaction InChI support

    cdk.github.io/nwo-openscience-

  19. big new feature got merged into the main development branch today, the support for the reaction InChI, RInChI. The pull request is here: github.com/cdk/cdk/issues/1063

  20. 📢 We are hiring! Apply NOW as #Cheminformatician – InChI and become part of our team!

    🔗 beilstein-institut.de/en/about

    If you have experience developing tools for digital infrastructure in chemistry and want to contribute to an international project with the #InChI_Trust and the InChI community, we invite you to apply for this position.

    Application deadline 📅 March 15, 2025
    RTs appreciated!
    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics
    #InChI_Trust

  21. 📢 We are hiring! Apply NOW as #Cheminformatician – InChI and become part of our team!

    🔗 beilstein-institut.de/en/about

    If you have experience developing tools for digital infrastructure in chemistry and want to contribute to an international project with the #InChI_Trust and the InChI community, we invite you to apply for this position.

    Application deadline 📅 March 15, 2025
    RTs appreciated!
    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics
    #InChI_Trust

  22. 📢 We are hiring! Apply NOW as #Cheminformatician – InChI and become part of our team!

    🔗 beilstein-institut.de/en/about

    If you have experience developing tools for digital infrastructure in chemistry and want to contribute to an international project with the #InChI_Trust and the InChI community, we invite you to apply for this position.

    Application deadline 📅 March 15, 2025
    RTs appreciated!
    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics
    #InChI_Trust

  23. 📢 We are hiring! Apply NOW as #Cheminformatician – InChI and become part of our team!

    🔗 beilstein-institut.de/en/about

    If you have experience developing tools for digital infrastructure in chemistry and want to contribute to an international project with the #InChI_Trust and the InChI community, we invite you to apply for this position.

    Application deadline 📅 March 15, 2025
    RTs appreciated!
    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics
    #InChI_Trust

  24. 📢 We are hiring! Apply NOW as #Cheminformatician – InChI and become part of our team!

    🔗 beilstein-institut.de/en/about

    If you have experience developing tools for digital infrastructure in chemistry and want to contribute to an international project with the #InChI_Trust and the InChI community, we invite you to apply for this position.

    Application deadline 📅 March 15, 2025
    RTs appreciated!
    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics
    #InChI_Trust

  25. 📢 We are hiring!
    #Cheminformatician – InChI
    🔗 beilstein-institut.de/en/about

    -develop tools and #opensource software for digital infrastructure for chemistry
    -directly contribute to an international project by working in conjunction with the #InChI_Trust
    -contribute to the goals of the @BeilsteinInstitut , a long-standing non-profit organization

    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics

  26. 📢 We are hiring!
    #Cheminformatician – InChI
    🔗 beilstein-institut.de/en/about

    -develop tools and #opensource software for digital infrastructure for chemistry
    -directly contribute to an international project by working in conjunction with the #InChI_Trust
    -contribute to the goals of the @BeilsteinInstitut , a long-standing non-profit organization

    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics

  27. 📢 We are hiring!
    #Cheminformatician – InChI
    🔗 beilstein-institut.de/en/about

    -develop tools and #opensource software for digital infrastructure for chemistry
    -directly contribute to an international project by working in conjunction with the #InChI_Trust
    -contribute to the goals of the @BeilsteinInstitut , a long-standing non-profit organization

    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics

  28. 📢 We are hiring!
    – InChI
    🔗 beilstein-institut.de/en/about

    -develop tools and software for digital infrastructure for chemistry
    -directly contribute to an international project by working in conjunction with the
    -contribute to the goals of the @BeilsteinInstitut , a long-standing non-profit organization

  29. 📢 We are hiring!
    #Cheminformatician – InChI
    🔗 beilstein-institut.de/en/about

    -develop tools and #opensource software for digital infrastructure for chemistry
    -directly contribute to an international project by working in conjunction with the #InChI_Trust
    -contribute to the goals of the @BeilsteinInstitut , a long-standing non-profit organization

    #chemjobs #InChI #openscience #digitalchemistry #cheminformatics

  30. Summerbreak is over, the next Stammtisch is just around the corner. On September 27, Prof. Sonja Herres-Pawlis & Dr. Gerd Blanke will talk about updates from #InChI.

    bit.ly/486Rgzt

    #chemistry #researchdata #chemtoot

  31. 📣 Version 1.07 of the #InChI chemical identifier standard was approved by #IUPAC and the #InChI_Trust! It includes: rebuilt development and testing pipeline, better supporting maintenance and extension of the standard. We are glad to support this work!

    inchi-trust.org/iupac-inchi-mo

  32. Fit For Future: InChI Standard Moves to GitHub

    Enhances transparency, collaboration, and reliability, supports future expansions, and promotes broader adoption of the International Chemical Identifier for linking chemical information across web sources

    chemistryviews.org/fit-for-fut

    #chemistry #chemistryviews #chemviews #inchi #IUPAC #Research

  33. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a #Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  34. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a #Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  35. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a #Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  36. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a #Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  37. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a #Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  38. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  39. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  40. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  41. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  42. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  43. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  44. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  45. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry

  46. We are looking to extend our current portfolio of open science projects by collaborating with the community on digital infrastructure projects in chemistry. If you tick the boxes of our requirements for your profile, we would be pleased to receive your application for the position of a Cheminformatician (f/m/d).

    🔗 beilstein-institut.de/en/about

    #inchi #digitialinfrastructure #cheminformatics #openscience #openinfrastructure #digitalchemistry