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| author | Navan Chauhan <navanchauhan@gmail.com> | 2024-04-03 09:36:58 -0600 |
|---|---|---|
| committer | GitHub <noreply@github.com> | 2024-04-03 09:36:58 -0600 |
| commit | 84ad5d8360fb0683f12f9bae8f29d6b36964dde3 (patch) | |
| tree | 64bb1d9675ac3d6a3604d512311a754b08c53be2 /docs/posts/2020-07-01-Install-rdkit-colab.html | |
| parent | 0e4b5fcc164cd8432678bdffd58b8c123acee186 (diff) | |
| parent | d00b2da99ef2d498074a6e4eb8d80995cdfc4476 (diff) | |
Merge branch 'vanilla-ssg' into dependabot/pip/jinja2-3.1.3
Diffstat (limited to 'docs/posts/2020-07-01-Install-rdkit-colab.html')
| -rw-r--r-- | docs/posts/2020-07-01-Install-rdkit-colab.html | 80 |
1 files changed, 61 insertions, 19 deletions
diff --git a/docs/posts/2020-07-01-Install-rdkit-colab.html b/docs/posts/2020-07-01-Install-rdkit-colab.html index b033784..68372d0 100644 --- a/docs/posts/2020-07-01-Install-rdkit-colab.html +++ b/docs/posts/2020-07-01-Install-rdkit-colab.html @@ -2,14 +2,27 @@ <html lang="en"> <head> - <link rel="stylesheet" href="https://unpkg.com/latex.css/style.min.css" /> + <meta http-equiv="X-UA-Compatible" content="IE=edge"> + <meta http-equiv="content-type" content="text/html; charset=utf-8"> + <meta name="viewport" content="width=device-width, initial-scale=1.0, maximum-scale=1"> + <meta name="theme-color" content="#6a9fb5"> + + <title>Installing RDKit on Google Colab</title> + + <!-- + <link rel="stylesheet" href="https://unpkg.com/latex.css/style.min.css" /> + --> + + <link rel="stylesheet" href="/assets/c-hyde.css" /> + + <link rel="stylesheet" href="http://fonts.googleapis.com/css?family=PT+Sans:400,400italic,700|Abril+Fatface"> + <link rel="stylesheet" href="/assets/main.css" /> <meta charset="utf-8"> <meta name="viewport" content="width=device-width, initial-scale=1.0"> - <title>Installing RDKit on Google Colab</title> <meta name="og:site_name" content="Navan Chauhan" /> <link rel="canonical" href="https://web.navan.dev/posts/2020-07-01-Install-rdkit-colab.html" /> - <meta name="twitter:url" content="https://web.navan.dev/posts/2020-07-01-Install-rdkit-colab.html /> + <meta name="twitter:url" content="https://web.navan.dev/posts/2020-07-01-Install-rdkit-colab.html" /> <meta name="og:url" content="https://web.navan.dev/posts/2020-07-01-Install-rdkit-colab.html" /> <meta name="twitter:title" content="Installing RDKit on Google Colab" /> <meta name="og:title" content="Installing RDKit on Google Colab" /> @@ -26,24 +39,52 @@ <script data-goatcounter="https://navanchauhan.goatcounter.com/count" async src="//gc.zgo.at/count.js"></script> <script defer data-domain="web.navan.dev" src="https://plausible.io/js/plausible.js"></script> - <link rel="manifest" href="manifest.json" /> + <link rel="manifest" href="/manifest.json" /> </head> -<body> - <center><nav style="display: block;"> -| -<a href="/">home</a> | -<a href="/about/">about/links</a> | -<a href="/posts/">posts</a> | -<!--<a href="/publications/">publications</a> |--> -<!--<a href="/repo/">iOS repo</a> |--> -<a href="/feed.rss">RSS Feed</a> | -</nav> -</center> +<body class="theme-base-0d"> + <div class="sidebar"> + <div class="container sidebar-sticky"> + <div class="sidebar-about"> + <h1><a href="/">Navan</a></h1> + <p class="lead" id="random-lead">Alea iacta est.</p> + </div> + + <ul class="sidebar-nav"> + <li><a class="sidebar-nav-item" href="/about/">about/links</a></li> + <li><a class="sidebar-nav-item" href="/posts/">posts</a></li> + <li><a class="sidebar-nav-item" href="/3D-Designs/">3D designs</a></li> + <li><a class="sidebar-nav-item" href="/feed.rss">RSS Feed</a></li> + <li><a class="sidebar-nav-item" href="/colophon/">colophon</a></li> + </ul> + <div class="copyright"><p>© 2019-2024. Navan Chauhan <br> <a href="/feed.rss">RSS</a></p></div> + </div> +</div> + +<script> +let phrases = [ + "Something Funny", "Veni, vidi, vici", "Alea iacta est", "In vino veritas", "Acta, non verba", "Castigat ridendo mores", + "Cui bono?", "Memento vivere", "अहम् ब्रह्मास्मि", "अनुगच्छतु प्रवाहं", "चरन्मार्गान्विजानाति", "coq de cheval", "我愛啤酒" + ]; + +let new_phrase = phrases[Math.floor(Math.random()*phrases.length)]; + +let lead = document.getElementById("random-lead"); +lead.innerText = new_phrase; +</script> + <div class="content container"> -<main> + <div class="post"> + <h1 id="installing-rdkit-on-google-colab">Installing RDKit on Google Colab</h1> + +<p><strong>Update: March 2024</strong> </p> - <h1>Installing RDKit on Google Colab</h1> +<p><code>rdkit-pypi</code> has been deprecated in favour of <code>rdkit</code></p> + +<p>You can simply run:</p> + +<pre><code>!pip install rdkit +</code></pre> <p><strong>EDIT:</strong> Try installing RDKit using pip</p> @@ -51,7 +92,7 @@ </code></pre> -<h2>Old Method (Still Works)</h2> +<h2 id="old-method-still-works">Old Method (Still Works)</h2> <p>RDKit is one of the most integral part of any Cheminfomatic specialist's toolkit but it is notoriously difficult to install unless you already have <code>conda</code> installed. I originally found this in a GitHub Gist but I have not been able to find that gist again :/ </p> @@ -149,14 +190,15 @@ logger.info("rdkit-{} installation finished!".format(rdkit.__version__)) install() ```</p> + </div> <blockquote>If you have scrolled this far, consider subscribing to my mailing list <a href="https://listmonk.navan.dev/subscription/form">here.</a> You can subscribe to either a specific type of post you are interested in, or subscribe to everything with the "Everything" list.</blockquote> <script data-isso="https://comments.navan.dev/" src="https://comments.navan.dev/js/embed.min.js"></script> <section id="isso-thread"> <noscript>Javascript needs to be activated to view comments.</noscript> </section> -</main> + </div> <script src="assets/manup.min.js"></script> <script src="/pwabuilder-sw-register.js"></script> </body> |