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Developments in the Digital Chemistry Space: An Update

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    Discussion
  • August 6, 2021 at 8:08 pm #134061

    Stuart Chalk
    Member

    Collaborative session notes: https://docs.google.com/document/d/1Pf3GeUe66zSRzkTJEBe1YmgwjzC1_8dC-N8CaEIweyU/edit?usp=sharing
     
    The session will run in two parts:

    40 minutes of lightning talks describing current digital activities in chemistry
    40 minutes of discussion: Future Visioning for CRDIG, effectively and actively bridge
    between RDA and other activities in digital chemistry space going forward

    Speakers from eight from different active projects will be invited to do lightning talks, for example:

    NFDI4Chem (National Research Data Infrastructure Consortium Chemistry project, Germany)
    PSDS (Physical Sciences Data science Service, UK)
    IUPAC projects (International Union of Pure and Applied Chemistry)

    InChI, SMILES+, Machine-Accessible Periodic Table, FAIRSpec, Gold Book

    UK Catalysis Hub (Cardiff University, UK)
    Four others to be invited

     

    Additional links to informative material

    https://nfdi4chem.de/
    https://www.psds.ac.uk/
    https://www.inchi-trust.org/
    https://iupac.org/what-we-do/digital-standards/
    https://goldbook.iupac.org/
    https://ukcatalysishub.co.uk/

    Applicable Pathways
    Semantics, Ontology, Standardisation, Data Infrastructures – Organisational to Environments

    Avoid conflict with the following group (1)
    InteroperAble Descriptions of Observable Property Terminology WG (I-ADOPT WG)

    Avoid conflict with the following group (3)
    RDA/WDS Scholarly Link Exchange (Scholix) WG

    Contact for group (email)
    schalk@unf.edu

    Group chair serving as contact person
    Stuart Chalk

    Meeting objectives
    As the move to open science and FAIR data accelerates, there are new activities in the chemical domain that are important to share with the RDA community.  This session will present many of these activities as a series of lightning talks, and each speaker will be asked to identify questions they have for attendees.  The hope is that this review of current activities will allow participants to identify common issues, alignments, and opportunities and receive input and feedback from other RDA groups.

    Please indicate the breakout slot (s) that would suit your meeting
    Breakout 2, Breakout 5, Breakout 8, Breakout 11, Breakout 14, Breakout 17, Breakout 20, Breakout 23

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