From 41a5eadac9e7b75dc9ca627dfc1c1c14fb60995a Mon Sep 17 00:00:00 2001
From: Felipe Lopes de Oliveira
 <33868364+lipelopesoliveira@users.noreply.github.com>
Date: Tue, 25 Apr 2023 15:14:26 -0300
Subject: [PATCH] Remove notebook

---
 src/pycofbuilder/Generate_COFs.ipynb | 157 ---------------------------
 1 file changed, 157 deletions(-)
 delete mode 100644 src/pycofbuilder/Generate_COFs.ipynb

diff --git a/src/pycofbuilder/Generate_COFs.ipynb b/src/pycofbuilder/Generate_COFs.ipynb
deleted file mode 100644
index c6a9e012..00000000
--- a/src/pycofbuilder/Generate_COFs.ipynb
+++ /dev/null
@@ -1,157 +0,0 @@
-{
- "cells": [
-  {
-   "cell_type": "code",
-   "execution_count": 1,
-   "metadata": {},
-   "outputs": [],
-   "source": [
-    "import os\n",
-    "\n",
-    "# importing module\n",
-    "import sys\n",
-    " \n",
-    "# appending a path\n",
-    "sys.path.append('C:\\\\Users\\\\lipel\\\\OneDrive\\\\Documentos\\\\GitHub\\\\pyCOFBuilder\\\\src')\n",
-    "\n",
-    "import pycofbuilder as COF\n"
-   ]
-  },
-  {
-   "cell_type": "markdown",
-   "metadata": {},
-   "source": [
-    "# List of COFs\n",
-    "\n",
-    "group_1 = [\n",
-    "    'C3_TPBZ_NH2-C2_TIEN_CHO-HCB_A-AA', \n",
-    "    'C3_TPBZ_NH2-C2_TIEN_CHO-HCB_A-AB1',\n",
-    "    'C3_TPBZ_NH2-C2_TIEN_CHO-HCB_A-AB2'\n",
-    "]\n",
-    "\n",
-    "S1 = COF.Reticulum()\n",
-    "S1.from_name(group_1[0])\n",
-    "S1.save(fmt='cif', supercell=[1,1,2])\n",
-    "S1.save(fmt='json', supercell=[1,1,2])\n",
-    "\n",
-    "S2 = COF.Reticulum()\n",
-    "S2.from_name(group_1[1])\n",
-    "S2.save(fmt='cif', supercell=[1,1,1])\n",
-    "S2.save(fmt='json', supercell=[1,1,1])\n",
-    "\n",
-    "S3 = COF.Reticulum()\n",
-    "S3.from_name(group_1[2])\n",
-    "S3.save(fmt='cif', supercell=[1,1,1])\n",
-    "S3.save(fmt='json', supercell=[1,1,1])"
-   ]
-  },
-  {
-   "attachments": {},
-   "cell_type": "markdown",
-   "metadata": {},
-   "source": [
-    "# Estrutura com problemas\n",
-    "\n",
-    "group_2 = [\n",
-    "    'C3_TRZN_Br-C2_PYEN_Br-HCB_A-AA',  \n",
-    "    'C3_TRZN_Br-C2_PYEN_Br-HCB_A-AB1',\n",
-    "    'C3_TRZN_Br-C2_PYEN_Br-HCB_A-AB2'\n",
-    "]\n",
-    "\n",
-    "S1 = COF.Reticulum()\n",
-    "S1.from_name(group_2[0])\n",
-    "S1.save(fmt='cif', supercell=[1,2,1])\n",
-    "S1.save(fmt='json', supercell=[1,2,1])\n",
-    "\n",
-    "S2 = COF.Reticulum()\n",
-    "S2.from_name(group_2[1])\n",
-    "S2.save(fmt='cif', supercell=[1,1,1])\n",
-    "S2.save(fmt='json', supercell=[1,1,1])\n",
-    "\n",
-    "S3 = COF.Reticulum()\n",
-    "S3.from_name(group_2[2])\n",
-    "S3.save(fmt='cif', supercell=[1,1,1])\n",
-    "S3.save(fmt='json', supercell=[1,1,1])"
-   ]
-  },
-  {
-   "cell_type": "code",
-   "execution_count": null,
-   "metadata": {},
-   "outputs": [],
-   "source": [
-    "# Estrutura com problemas\n",
-    "\n",
-    "group_3 = [\n",
-    "    'C3_TPTZ_NH2-C2_TIEN_CHO-HCB_A-AA',  \n",
-    "    'C3_TPTZ_NH2-C2_TIEN_CHO-HCB_A-AB1',\n",
-    "    'C3_TPTZ_NH2-C2_TIEN_CHO-HCB_A-AB2'\n",
-    "]\n",
-    "\n",
-    "\n",
-    "S1 = COF.Reticulum()\n",
-    "S1.from_name(group_3[0])\n",
-    "S1.save(fmt='cif', supercell=[1,1,2])\n",
-    "S1.save(fmt='json', supercell=[1,1,2])\n",
-    "\n",
-    "S2 = COF.Reticulum()\n",
-    "S2.from_name(group_3[1])\n",
-    "S2.save(fmt='cif', supercell=[1,1,1])\n",
-    "S2.save(fmt='json', supercell=[1,1,1])\n",
-    "\n",
-    "S3 = COF.Reticulum()\n",
-    "S3.from_name(group_3[2])\n",
-    "S3.save(fmt='cif', supercell=[1,1,1])\n",
-    "S3.save(fmt='json', supercell=[1,1,1])"
-   ]
-  },
-  {
-   "cell_type": "code",
-   "execution_count": 2,
-   "metadata": {},
-   "outputs": [
-    {
-     "name": "stdout",
-     "output_type": "stream",
-     "text": [
-      "C3_TRZN_Br-C2_BENZ_Br_H_H-HCB_A-AA                            monoclinic  P    P2/m # 10     4  sym. op.\n"
-     ]
-    }
-   ],
-   "source": [
-    "S1 = COF.Reticulum()\n",
-    "S1.from_name('C3_TRZN_Br-C2_BENZ_Br-HCB_A-AA')\n",
-    "S1.save(fmt='cif', supercell=[1,1,1])"
-   ]
-  },
-  {
-   "cell_type": "code",
-   "execution_count": null,
-   "metadata": {},
-   "outputs": [],
-   "source": []
-  }
- ],
- "metadata": {
-  "kernelspec": {
-   "display_name": "pycofbuilder",
-   "language": "python",
-   "name": "python3"
-  },
-  "language_info": {
-   "codemirror_mode": {
-    "name": "ipython",
-    "version": 3
-   },
-   "file_extension": ".py",
-   "mimetype": "text/x-python",
-   "name": "python",
-   "nbconvert_exporter": "python",
-   "pygments_lexer": "ipython3",
-   "version": "3.11.0"
-  },
-  "orig_nbformat": 4
- },
- "nbformat": 4,
- "nbformat_minor": 2
-}