{
  "id": 99875,
  "title": "A Hack to Color J-coupled Atoms in 3D",
  "url": "/competitions/champs-scalar-coupling/discussion/99875",
  "author_name": "",
  "post_date": "2019-07-15T03:57:03.719260600Z",
  "votes": 4,
  "comment_count": 3,
  "views": 0,
  "content": "<p><img src=\"https://www.googleapis.com/download/storage/v1/b/kaggle-user-content/o/inbox%2F256034%2F8437314cf8ea8b244d91be549a4ad4b3%2F3D_view_color_hack_illustration2.jpg?generation=1563162851977006&amp;alt=media\" alt=\"\"></p>\n\n<p><a href=\"https://www.kaggle.com/stocks/3d-molecule-visualization-with-coloring-hack\">Molecule 3D Viewer with Quick Hack Kernel link</a></p>\n\n<p>Suggestions are welcomed!</p>",
  "messages": [
    {
      "id": "575099",
      "postDate": "07/15/2019 03:57:03",
      "content": "<p><img src=\"https://www.googleapis.com/download/storage/v1/b/kaggle-user-content/o/inbox%2F256034%2F8437314cf8ea8b244d91be549a4ad4b3%2F3D_view_color_hack_illustration2.jpg?generation=1563162851977006&amp;alt=media\" alt=\"\"></p>\n\n<p><a href=\"https://www.kaggle.com/stocks/3d-molecule-visualization-with-coloring-hack\">Molecule 3D Viewer with Quick Hack Kernel link</a></p>\n\n<p>Suggestions are welcomed!</p>",
      "rawMarkdown": "![](https://www.googleapis.com/download/storage/v1/b/kaggle-user-content/o/inbox%2F256034%2F8437314cf8ea8b244d91be549a4ad4b3%2F3D_view_color_hack_illustration2.jpg?generation=1563162851977006&amp;alt=media)\n\n[Molecule 3D Viewer with Quick Hack Kernel link](https://www.kaggle.com/stocks/3d-molecule-visualization-with-coloring-hack)\n\nSuggestions are welcomed!",
      "votes": null
    },
    {
      "id": "575591",
      "postDate": "07/15/2019 17:42:42",
      "content": "<p>Great 3D represntation! will be a help, thank you for making this public!</p>",
      "rawMarkdown": "Great 3D represntation! will be a help, thank you for making this public!",
      "votes": null
    },
    {
      "id": "577036",
      "postDate": "07/16/2019 09:10:25",
      "content": "<p>Goooood!!! :)</p>",
      "rawMarkdown": "Goooood!!! :)",
      "votes": null
    },
    {
      "id": "577048",
      "postDate": "07/16/2019 09:29:03",
      "content": "<p>Thanks for the great kernel! Have you seen the plotting capability in <code>ase</code>?\n<a href=\"https://wiki.fysik.dtu.dk/ase/ase/visualize/visualize.html?highlight=plot#viewer-for-jupyter-notebooks\">https://wiki.fysik.dtu.dk/ase/ase/visualize/visualize.html?highlight=plot#viewer-for-jupyter-notebooks</a></p>\n\n<p>I've not played with this myself but I think you can use the <code>custom_colors()</code> method to change the colour of some atoms (as you have done) but without actually changing the atom type. </p>\n\n<p>Edit: I think <code>custom_colors()</code> changes the colour for every atom of that type, but it's probably worth digging around in <code>ase</code> as it is super powerful</p>",
      "rawMarkdown": "Thanks for the great kernel! Have you seen the plotting capability in `ase`?\nhttps://wiki.fysik.dtu.dk/ase/ase/visualize/visualize.html?highlight=plot#viewer-for-jupyter-notebooks\n\nI've not played with this myself but I think you can use the `custom_colors()` method to change the colour of some atoms (as you have done) but without actually changing the atom type. \n\nEdit: I think `custom_colors()` changes the colour for every atom of that type, but it's probably worth digging around in `ase` as it is super powerful",
      "votes": null
    }
  ],
  "comments": [
    {
      "id": 575591,
      "author_name": "rahul197",
      "author_url": "",
      "post_date": "07/15/2019 17:42:42",
      "content": "<p>Great 3D represntation! will be a help, thank you for making this public!</p>",
      "votes": null,
      "replies": []
    },
    {
      "id": 577036,
      "author_name": "seriousran",
      "author_url": "",
      "post_date": "07/16/2019 09:10:25",
      "content": "<p>Goooood!!! :)</p>",
      "votes": null,
      "replies": []
    },
    {
      "id": 577048,
      "author_name": "anjum48",
      "author_url": "",
      "post_date": "07/16/2019 09:29:03",
      "content": "<p>Thanks for the great kernel! Have you seen the plotting capability in <code>ase</code>?\n<a href=\"https://wiki.fysik.dtu.dk/ase/ase/visualize/visualize.html?highlight=plot#viewer-for-jupyter-notebooks\">https://wiki.fysik.dtu.dk/ase/ase/visualize/visualize.html?highlight=plot#viewer-for-jupyter-notebooks</a></p>\n\n<p>I've not played with this myself but I think you can use the <code>custom_colors()</code> method to change the colour of some atoms (as you have done) but without actually changing the atom type. </p>\n\n<p>Edit: I think <code>custom_colors()</code> changes the colour for every atom of that type, but it's probably worth digging around in <code>ase</code> as it is super powerful</p>",
      "votes": null,
      "replies": []
    }
  ],
  "raw_markdown_by_id": {
    "575099": "![](https://www.googleapis.com/download/storage/v1/b/kaggle-user-content/o/inbox%2F256034%2F8437314cf8ea8b244d91be549a4ad4b3%2F3D_view_color_hack_illustration2.jpg?generation=1563162851977006&amp;alt=media)\n\n[Molecule 3D Viewer with Quick Hack Kernel link](https://www.kaggle.com/stocks/3d-molecule-visualization-with-coloring-hack)\n\nSuggestions are welcomed!",
    "575591": "Great 3D represntation! will be a help, thank you for making this public!",
    "577036": "Goooood!!! :)",
    "577048": "Thanks for the great kernel! Have you seen the plotting capability in `ase`?\nhttps://wiki.fysik.dtu.dk/ase/ase/visualize/visualize.html?highlight=plot#viewer-for-jupyter-notebooks\n\nI've not played with this myself but I think you can use the `custom_colors()` method to change the colour of some atoms (as you have done) but without actually changing the atom type. \n\nEdit: I think `custom_colors()` changes the colour for every atom of that type, but it's probably worth digging around in `ase` as it is super powerful"
  },
  "source": "meta"
}