init.ipynb

{
 "cells": [
  {
   "cell_type": "markdown",
   "source": "## Initialization Notebook\nThis is your initialization notebook.\n\n**What's this for?**\n\nYou can put custom code you want us to run every time we setup your environment in here. \n\n**Awesome! Anything I should not put in here?**\n\nPlease don't install `jupyter` or `jedi` packages, they would break your Deepnote environment. Also, no need to put `!pip install`s here, we already save those automatically!\n\n**I want to learn more!**\n\nGreat! Just [head over to our docs](https://docs.deepnote.com/environment/custom-initialization).",
   "metadata": {
    "tags": [],
    "cell_id": "00000-3bc72e86-023f-4b43-8bab-f33ccbf562ac",
    "deepnote_cell_type": "markdown"
   }
  },
  {
   "cell_type": "code",
   "metadata": {
    "tags": [],
    "cell_id": "00001-3f522f3f-a408-4e39-bf93-bb3e9f757b58",
    "deepnote_to_be_reexecuted": false,
    "source_hash": "60b37886",
    "execution_start": 1623913376983,
    "execution_millis": 41066,
    "deepnote_cell_type": "code"
   },
   "source": "%%bash\n# If your project has a 'requirements.txt' file, we'll install it here apart from blacklisted packages that interfere with Deepnote (see above).\nif test -f requirements.txt\n  then\n    sed -i '/jedi/d;/jupyter/d;' ./requirements.txt\n    pip install -r ./requirements.txt\n  else echo \"There's no requirements.txt, so nothing to install. This is the case with most projects.\"\nfi",
   "outputs": [
    {
     "name": "stdout",
     "text": "Collecting xlrd\n  Downloading xlrd-2.0.1-py2.py3-none-any.whl (96 kB)\nRequirement already satisfied: numpy in /shared-libs/python3.7/py/lib/python3.7/site-packages (from -r ./requirements.txt (line 2)) (1.19.5)\nCollecting ase\n  Downloading ase-3.21.1-py3-none-any.whl (2.2 MB)\nCollecting qml\n  Downloading qml-0.4.0.27.tar.gz (41 kB)\nRequirement already satisfied: scipy>=0.18.1 in /shared-libs/python3.7/py/lib/python3.7/site-packages (from ase->-r ./requirements.txt (line 3)) (1.6.3)\nRequirement already satisfied: matplotlib>=2.0.0 in /shared-libs/python3.7/py/lib/python3.7/site-packages (from ase->-r ./requirements.txt (line 3)) (3.4.2)\nRequirement already satisfied: pillow>=6.2.0 in /shared-libs/python3.7/py/lib/python3.7/site-packages (from matplotlib>=2.0.0->ase->-r ./requirements.txt (line 3)) (8.2.0)\nRequirement already satisfied: python-dateutil>=2.7 in /shared-libs/python3.7/py-core/lib/python3.7/site-packages (from matplotlib>=2.0.0->ase->-r ./requirements.txt (line 3)) (2.8.1)\nRequirement already satisfied: kiwisolver>=1.0.1 in /shared-libs/python3.7/py/lib/python3.7/site-packages (from matplotlib>=2.0.0->ase->-r ./requirements.txt (line 3)) (1.3.1)\nRequirement already satisfied: pyparsing>=2.2.1 in /shared-libs/python3.7/py-core/lib/python3.7/site-packages (from matplotlib>=2.0.0->ase->-r ./requirements.txt (line 3)) (2.4.7)\nRequirement already satisfied: cycler>=0.10 in /shared-libs/python3.7/py/lib/python3.7/site-packages (from matplotlib>=2.0.0->ase->-r ./requirements.txt (line 3)) (0.10.0)\nRequirement already satisfied: six in /shared-libs/python3.7/py-core/lib/python3.7/site-packages (from cycler>=0.10->matplotlib>=2.0.0->ase->-r ./requirements.txt (line 3)) (1.16.0)\nBuilding wheels for collected packages: qml\n  Building wheel for qml (setup.py): started\n  Building wheel for qml (setup.py): finished with status 'done'\n  Created wheel for qml: filename=qml-0.4.0.27-cp37-cp37m-linux_x86_64.whl size=1046945 sha256=1ad63d1d76722390051473d5bb1f03dd4e61b79b19c188ce239eaa29bad8495d\n  Stored in directory: /root/.cache/pip/wheels/e4/6f/cc/cc6ed17565977d62aab6730e348c2e9d8c51c559896c467f74\nSuccessfully built qml\nInstalling collected packages: xlrd, qml, ase\nSuccessfully installed ase-3.21.1 qml-0.4.0.27 xlrd-2.0.1\n",
     "output_type": "stream"
    }
   ],
   "execution_count": null
  },
  {
   "cell_type": "markdown",
   "source": "<a style='text-decoration:none;line-height:16px;display:flex;color:#5B5B62;padding:10px;justify-content:end;' href='https://deepnote.com?utm_source=created-in-deepnote-cell&projectId=94f9cce8-e723-4189-88a0-bcfa7e89097f' target=\"_blank\">\n<img alt='Created in deepnote.com' style='display:inline;max-height:16px;margin:0px;margin-right:7.5px;' src='data:image/svg+xml;base64,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' > </img>\nCreated in <span style='font-weight:600;margin-left:4px;'>Deepnote</span></a>",
   "metadata": {
    "tags": [],
    "created_in_deepnote_cell": true,
    "deepnote_cell_type": "markdown"
   }
  }
 ],
 "nbformat": 4,
 "nbformat_minor": 2,
 "metadata": {
  "orig_nbformat": 2,
  "deepnote": {
   "is_reactive": false
  },
  "deepnote_notebook_id": "de7e709d-a3a4-4432-83e9-c79b7fe399a5",
  "deepnote_execution_queue": []
 }
}