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#iupac

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NiceMicro<p>So...</p><p>Is it real, that the International Union for Pure and Applied Chemistry is asking $199 for a book that contains the correct terminology for analytical chemistry???</p><p>WTF?!</p><p><a href="https://books.rsc.org/books/edited-volume/2059/Compendium-of-Terminology-in-Analytical-Chemistry" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://</span><span class="ellipsis">books.rsc.org/books/edited-vol</span><span class="invisible">ume/2059/Compendium-of-Terminology-in-Analytical-Chemistry</span></a></p><p><a href="https://fosstodon.org/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://fosstodon.org/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a> <a href="https://fosstodon.org/tags/science" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>science</span></a> <a href="https://fosstodon.org/tags/payWall" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>payWall</span></a></p>
Blue Obelisk<p>hi <a href="https://fosstodon.org/tags/chemsky" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemsky</span></a> and <a href="https://fosstodon.org/tags/Fediverse" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>Fediverse</span></a>, one has to have some goals, right? We think so too: we are going to collect 10M parsable and unique <a href="https://fosstodon.org/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a> names as a unique CCZero dataset <a href="https://github.com/BlueObelisk/iupac-names/issues" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://</span><span class="ellipsis">github.com/BlueObelisk/iupac-n</span><span class="invisible">ames/issues</span></a></p><p><a href="https://fosstodon.org/tags/openscience" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>openscience</span></a> <a href="https://fosstodon.org/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a></p>
The Chemistry Development Kit<p>big new feature got merged into the main development branch today, the support for the reaction InChI, RInChI. The pull request is here: <a href="https://github.com/cdk/cdk/issues/1063" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://</span><span class="">github.com/cdk/cdk/issues/1063</span><span class="invisible"></span></a></p><p><a href="https://fosstodon.org/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://fosstodon.org/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a> <a href="https://fosstodon.org/tags/reaction" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>reaction</span></a> <a href="https://fosstodon.org/tags/inchi" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>inchi</span></a> <a href="https://fosstodon.org/tags/openscience" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>openscience</span></a> <a href="https://fosstodon.org/tags/opensource" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>opensource</span></a></p>
Egon Willigh☮gen 🟥<p>interesting progress: "STOUT V2.0: SMILES to IUPAC name conversion using transformer models" <a href="https://doi.org/10.1186/s13321-024-00941-x" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://</span><span class="ellipsis">doi.org/10.1186/s13321-024-009</span><span class="invisible">41-x</span></a></p><p>"The model was trained on a dataset of nearly 1 billion SMILES and corresponding IUPAC names, generated using OpenEye's Lexichem software. This new version achieves very high accuracy on test and benchmark datasets, demonstrating improved capability in producing longer IUPAC names with fewer errors overall."</p><p><a href="https://mastodon.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mastodon.social/tags/cheminformatics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>cheminformatics</span></a> <a href="https://mastodon.social/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a></p>
Cord Wiljes<p>When you buy used books, sometimes you learn about the copy’s history by markings on the inside. Here is one I received yesterday.</p><p><a href="https://nfdi.social/tags/usedbooks" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>usedbooks</span></a> <a href="https://nfdi.social/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a> <a href="https://nfdi.social/tags/terminology" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>terminology</span></a></p>
Matt Willemsen<p>Multi-language chemistry dictionary to be created to avoid confusion<br><a href="https://www.chemistryworld.com/news/chemistry-body-to-create-multi-language-chemistry-dictionary-to-avoid-confusion/4020071.article" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://www.</span><span class="ellipsis">chemistryworld.com/news/chemis</span><span class="invisible">try-body-to-create-multi-language-chemistry-dictionary-to-avoid-confusion/4020071.article</span></a> <a href="https://mastodon.social/tags/Iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>Iupac</span></a> <a href="https://mastodon.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mastodon.social/tags/dictionary" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>dictionary</span></a></p>
Beilstein-Institut<p>📣 Version 1.07 of the <a href="https://hessen.social/tags/InChI" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>InChI</span></a> chemical identifier standard was approved by <a href="https://hessen.social/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a> and the <a href="https://hessen.social/tags/InChI_Trust" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>InChI_Trust</span></a>! It includes: rebuilt development and testing pipeline, better supporting maintenance and extension of the standard. We are glad to support this work! </p><p><a href="https://inchi-trust.org/iupac-inchi-moves-to-github-to-support-sustainable-chemical-standards-development/" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://</span><span class="ellipsis">inchi-trust.org/iupac-inchi-mo</span><span class="invisible">ves-to-github-to-support-sustainable-chemical-standards-development/</span></a></p>
Wendy Patterson<p>Version 1.07 of the InChI chemical identifier standard was approved by <a href="https://mas.to/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a> and the <a href="https://mas.to/tags/InChI_Trust" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>InChI_Trust</span></a> and includes: rebuilt development and testing pipeline, better supporting maintenance and extension of the standard. </p><p>The <span class="h-card" translate="no"><a href="https://hessen.social/@BeilsteinInstitut" class="u-url mention" rel="nofollow noopener noreferrer" target="_blank">@<span>BeilsteinInstitut</span></a></span> gladly supports this work! </p><p>More info: <a href="https://www.inchi-trust.org/iupac-inchi-moves-to-github-to-support-sustainable-chemical-standards-development/" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://www.</span><span class="ellipsis">inchi-trust.org/iupac-inchi-mo</span><span class="invisible">ves-to-github-to-support-sustainable-chemical-standards-development/</span></a></p>
ChemistryViews<p>Fit For Future: InChI Standard Moves to GitHub</p><p>Enhances transparency, collaboration, and reliability, supports future expansions, and promotes broader adoption of the International Chemical Identifier for linking chemical information across web sources</p><p><a href="https://www.chemistryviews.org/fit-for-future-inchi-standard-moves-to-github/" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://www.</span><span class="ellipsis">chemistryviews.org/fit-for-fut</span><span class="invisible">ure-inchi-standard-moves-to-github/</span></a></p><p><a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mstdn.social/tags/chemistryviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryviews</span></a> <a href="https://mstdn.social/tags/chemviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemviews</span></a> <a href="https://mstdn.social/tags/inchi" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>inchi</span></a> <a href="https://mstdn.social/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a> <a href="https://mstdn.social/tags/Research" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>Research</span></a></p>
Hanna Shmagun<p>Overview of the upcoming white paper from <a href="https://mastodon.social/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a> (International Union of Pure and Applied Chemistry) on current and potential future applications of <a href="https://mastodon.social/tags/blockchain" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>blockchain</span></a> across the scientific research cycle. <br>Some nonprofit use cases from the academic sector: the Bloxberg Consortium (out of the Max Planck Digital Library) and the <a href="https://mastodon.social/tags/OpenScience" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>OpenScience</span></a> Chain consortium (funded by the U.S. National Science Foundation). </p><p><a href="https://www.degruyter.com/document/doi/10.1515/ci-2024-0303/html" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://www.</span><span class="ellipsis">degruyter.com/document/doi/10.</span><span class="invisible">1515/ci-2024-0303/html</span></a></p>
ChemistryViews<p>How to Share And Reuse Chemical Data?<br>@IUPAC launched interactive guide for digital chemical data - The FAIR Chemistry Cookbook</p><p><a href="https://www.chemistryviews.org/how-to-share-and-reuse-chemical-data/" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://www.</span><span class="ellipsis">chemistryviews.org/how-to-shar</span><span class="invisible">e-and-reuse-chemical-data/</span></a></p><p><a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mstdn.social/tags/chemistryviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryviews</span></a> <a href="https://mstdn.social/tags/chemviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemviews</span></a> <a href="https://mstdn.social/tags/chemiverse" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemiverse</span></a> <a href="https://mstdn.social/tags/fairdata" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>fairdata</span></a> <a href="https://mstdn.social/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a></p>
NiceMicro<p>I would be very happy if the international scientific language wasn't a 100% English, especially when we have symbols that come from other languages. I mean, we should probably also call mercury "hydrargum", it is a lot cooler.</p><p><a href="https://fosstodon.org/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://fosstodon.org/tags/nomenclature" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>nomenclature</span></a> <a href="https://fosstodon.org/tags/science" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>science</span></a> <a href="https://fosstodon.org/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a></p>
NiceMicro<p>In your native tongue, which of the below options is closest to how you call the element with the symbol 'K'?</p><p>Boosts are appreciated for increased coverage.</p><p><a href="https://fosstodon.org/tags/Chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>Chemistry</span></a> <a href="https://fosstodon.org/tags/Science" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>Science</span></a> <a href="https://fosstodon.org/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a></p>
Getzler Lab at KenyonCollege<p>how is it that in this, the year of our Lavoisier 281, that amide can still refer to two different functional groups? surely <a href="https://mstdn.science/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a> has a recommendation I am missing? <a href="https://mstdn.science/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mstdn.science/tags/nomenclature" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>nomenclature</span></a></p>
ChemistryViews<p>Experiences from building the young program for IUPAC|CHAINS 2023: <br>A reflection by young chemists for young chemists</p><p><a href="https://doi.org/10.1002/chemv.202400002" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://</span><span class="ellipsis">doi.org/10.1002/chemv.20240000</span><span class="invisible">2</span></a></p><p><a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mstdn.social/tags/chemistryviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryviews</span></a> <a href="https://mstdn.social/tags/chemviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemviews</span></a> <a href="https://mstdn.social/tags/iycn" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iycn</span></a> <a href="https://mstdn.social/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a> <a href="https://mstdn.social/tags/youngchemists" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>youngchemists</span></a></p>
Egon Willighagen<p>updated <a href="https://social.edu.nl/tags/python" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>python</span></a> script: IUPAC name to InChI (and InChIKey): <a href="https://colab.research.google.com/drive/1bjKrt7Ay5_wv-Ymnnc5hTYsYNfDeQh8p?usp=sharing" rel="nofollow noopener noreferrer" translate="no" target="_blank"><span class="invisible">https://</span><span class="ellipsis">colab.research.google.com/driv</span><span class="invisible">e/1bjKrt7Ay5_wv-Ymnnc5hTYsYNfDeQh8p?usp=sharing</span></a> <a href="https://social.edu.nl/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://social.edu.nl/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a> <a href="https://social.edu.nl/tags/cdk" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>cdk</span></a> (ht <span class="h-card" translate="no"><a href="https://scholar.social/@cthoyt" class="u-url mention" rel="nofollow noopener noreferrer" target="_blank">@<span>cthoyt</span></a></span> for continued <a href="https://social.edu.nl/tags/pybacting" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>pybacting</span></a> development!)</p>
ChemistryViews<p>IUPAC|CHAINS 2023: Insights from the World Chemistry Congress: <br>Research, superpowers, beyond the silicon age, AI, stopping misinformation, Cohen’s hammer, equity, networking, and more</p><p><a href="https://bit.ly/3qSLaSp" rel="nofollow noopener noreferrer" target="_blank"><span class="invisible">https://</span><span class="">bit.ly/3qSLaSp</span><span class="invisible"></span></a></p><p><a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mstdn.social/tags/chemistryviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryviews</span></a> <a href="https://mstdn.social/tags/chemviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemviews</span></a> <a href="https://mstdn.social/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a> <a href="https://mstdn.social/tags/iupac2023" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac2023</span></a> <a href="https://mstdn.social/tags/thehague" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>thehague</span></a> <a href="https://mstdn.social/tags/kncv" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>kncv</span></a> <a href="https://mstdn.social/tags/gdch" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>gdch</span></a> <a href="https://mstdn.social/tags/chemistryeuropeaward" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryeuropeaward</span></a> <a href="https://mstdn.social/tags/chemistryeurope" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryeurope</span></a></p>
Stephan Hacker<p>The last day of <a href="https://mstdn.science/tags/IUPACCHAINS2023" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPACCHAINS2023</span></a> has arrived. Looking forward to the final program points including the Meet and Greet with Timothy Caulfield, the talks by Kevin Neumann and Chad Mirkin as well as the closing ceremony. <a href="https://mstdn.science/tags/Chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>Chemistry</span></a> <a href="https://mstdn.science/tags/ChemiVerse" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>ChemiVerse</span></a> <a href="https://mstdn.science/tags/IUPAC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>IUPAC</span></a></p>
Fran Kerton<p><a href="https://mas.to/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a> <a href="https://mas.to/tags/iupacchains2023" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupacchains2023</span></a> having a wonderful time at the General Assembly and IUPAC Chains congress in The Hague <a href="https://mas.to/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mas.to/tags/sciencediplomacy" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>sciencediplomacy</span></a> <a href="https://mas.to/tags/youngprofessionals" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>youngprofessionals</span></a></p>
ChemistryViews<p>🥇We are looking forward to the presentation of the Inaugural @ChemEurope<br> Award to Bert Weckhuysenat, Utrecht University, the opening of @IUPAC2023</p><p>If you are in The Hague: ⏰Today 16:00 - 18:30</p><p>Or read an interview with Bert Weckhuysen: <a href="https://www.chemistryviews.org/enjoy-being-like-a-detective/" rel="nofollow noopener noreferrer" target="_blank"><span class="invisible">https://www.</span><span class="ellipsis">chemistryviews.org/enjoy-being</span><span class="invisible">-like-a-detective/</span></a></p><p><a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistry</span></a> <a href="https://mstdn.social/tags/chemistryviews" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryviews</span></a> <a href="https://mstdn.social/tags/chemiverse" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemiverse</span></a> <a href="https://mstdn.social/tags/chemistryeurope" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryeurope</span></a> <a href="https://mstdn.social/tags/chemistryaward" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>chemistryaward</span></a> <a href="https://mstdn.social/tags/iupac" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac</span></a> <a href="https://mstdn.social/tags/iupac2023" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#<span>iupac2023</span></a></p>