{
  "version": "https://jsonfeed.org/version/1.1",
  "title": "chem-bla-ics",
  "description": "Chemblaics (pronounced chem-bla-ics) is the science that uses open science and computers to solve problems in chemistry, biochemistry and related fields.",
  "home_page_url": "https://chem-bla-ics.linkedchemistry.info/",
  "feed_url": "https://chem-bla-ics.linkedchemistry.info/2009/09/05/nmrshiftdb-rdf-1-spectra-by-inchi.json",
  "icon": "https://chem-bla-ics.linkedchemistry.info/assets/images/chem-bla-ics_logo.png",
  "language": "en",
  "authors": [
    {
      "name": "Egon Willighagen",
      "url": "https://orcid.org/0000-0001-7542-0286",
      "_orcid": "0000-0001-7542-0286"
    }
  ],
  "items": [

    {
      "id": "https://doi.org/10.59350/7k8wn-jee62",
      "url": "https://chem-bla-ics.linkedchemistry.info/2009/09/05/nmrshiftdb-rdf-1-spectra-by-inchi.html",
      "title": "NMRShiftDB RDF #1: Spectra by InChI",
      "content_html": "<p>Originally, I wanted to include a SPARQL query in <a href=\"https://chem-bla-ics.linkedchemistry.info/2009/09/04/nmrshiftdb-enters-rdfopenmoleculesnet-2.html\">my yesterdays blog <i class=\"fa-solid fa-recycle fa-xs\"></i></a>\nshowing how to retrieve <a href=\"http://www.nmrshiftdb.org/\">NMRShiftDB</a> spectra based on an InChIKey, but it horribly failed. I have yet to discover why. This\nmorning I discovered that it is specific for that field, and that using the same thing with InChI is no problem:</p>\n\n<script src=\"https://gist.github.com/181307.js\"></script>",
      "summary": "Originally, I wanted to include a SPARQL query in my yesterdays blog showing how to retrieve NMRShiftDB spectra based on an InChIKey, but it horribly failed. I have yet to discover why. This morning I discovered that it is specific for that field, and that using the same thing with InChI is no problem:",
      
      "date_published": "2009-09-05T00:00:00+00:00",
      "date_modified": "2026-03-07T00:00:00+00:00",
      "tags": ["nmrshiftdb","sparql"],
      
      
      
      
      
      
        "authors": [ { "name": "Egon Willighagen", "url": "https://orcid.org/0000-0001-7542-0286" } ]
      
    }

  ]
}