[3af7d7]: / docs / notebooks / talk2biomodels / tutorial_load_model.ipynb

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{
 "cells": [
  {
   "cell_type": "markdown",
   "metadata": {},
   "source": [
    "Working with SBML models using basico"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 1,
   "metadata": {},
   "outputs": [
    {
     "name": "stderr",
     "output_type": "stream",
     "text": [
      "c:\\Users\\Wehling\\code\\AIAgents-Hackathon\\.venv\\Lib\\site-packages\\tqdm\\auto.py:21: TqdmWarning: IProgress not found. Please update jupyter and ipywidgets. See https://ipywidgets.readthedocs.io/en/stable/user_install.html\n",
      "  from .autonotebook import tqdm as notebook_tqdm\n"
     ]
    }
   ],
   "source": [
    "import basico"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 9,
   "metadata": {},
   "outputs": [],
   "source": [
    "# load SBML model\n",
    "model = basico.load_model(\"./Dwivedi_Model537_annotated.xml\")"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 10,
   "metadata": {},
   "outputs": [
    {
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       "  <thead>\n",
       "    <tr style=\"text-align: right;\">\n",
       "      <th></th>\n",
       "      <th>compartment</th>\n",
       "      <th>type</th>\n",
       "      <th>unit</th>\n",
       "      <th>initial_concentration</th>\n",
       "      <th>initial_particle_number</th>\n",
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       "      <th></th>\n",
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       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>4.356289e-04</td>\n",
       "      <td>2.623419e+11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>4.356289e-04</td>\n",
       "      <td>2.623419e+11</td>\n",
       "      <td>-1.565877e-17</td>\n",
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       "      <td>Metabolite_88</td>\n",
       "      <td>mwf626e95e_543f_41e4_aad4_c6bf60ab345b</td>\n",
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       "      <td>serum</td>\n",
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       "      <td>nmol/l</td>\n",
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       "      <td>2.348635e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>3.900000e+00</td>\n",
       "      <td>2.348635e+15</td>\n",
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       "      <td>Metabolite_89</td>\n",
       "      <td>mwbbbce920_e8dd_4320_9386_fc94bfb2fc99</td>\n",
       "      <td>0.997567</td>\n",
       "      <td>sgp130{serum}</td>\n",
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       "      <th>sR_IL6_sgp130</th>\n",
       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>8.740607e-02</td>\n",
       "      <td>5.263716e+13</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>8.740607e-02</td>\n",
       "      <td>5.263716e+13</td>\n",
       "      <td>-2.367565e-16</td>\n",
       "      <td>-1.425781e-01</td>\n",
       "      <td>Metabolite_90</td>\n",
       "      <td>mw810ff751_fa4e_4143_bd50_169b3e325e1e</td>\n",
       "      <td>9.190533</td>\n",
       "      <td>sR_IL6_sgp130{serum}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>CRP</th>\n",
       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>2.210637e+02</td>\n",
       "      <td>1.331277e+17</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>2.210637e+02</td>\n",
       "      <td>1.331277e+17</td>\n",
       "      <td>6.243627e-13</td>\n",
       "      <td>3.760000e+02</td>\n",
       "      <td>Metabolite_91</td>\n",
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       "      <td>2.777778</td>\n",
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       "    <tr>\n",
       "      <th>sR</th>\n",
       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>4.253507e+00</td>\n",
       "      <td>2.561522e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>4.253507e+00</td>\n",
       "      <td>2.561522e+15</td>\n",
       "      <td>1.307675e-14</td>\n",
       "      <td>7.875000e+00</td>\n",
       "      <td>Metabolite_92</td>\n",
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       "      <td>3.283772</td>\n",
       "      <td>sR{serum}</td>\n",
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       "    <tr>\n",
       "      <th>sR_IL6</th>\n",
       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.094243e-03</td>\n",
       "      <td>6.589683e+11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>1.094243e-03</td>\n",
       "      <td>6.589683e+11</td>\n",
       "      <td>5.032090e-17</td>\n",
       "      <td>3.030396e-02</td>\n",
       "      <td>Metabolite_93</td>\n",
       "      <td>mw03db56ac_8dc6_4931_ae82_fef706d2ee3d</td>\n",
       "      <td>0.518949</td>\n",
       "      <td>sR_IL6{serum}</td>\n",
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       "      <th>Ab</th>\n",
       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>2.381820e-29</td>\n",
       "      <td>1.434365e-14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>2.381820e-29</td>\n",
       "      <td>1.434365e-14</td>\n",
       "      <td>5.129906e-26</td>\n",
       "      <td>3.089302e-11</td>\n",
       "      <td>Metabolite_94</td>\n",
       "      <td>mwf345ed7a_0622_403c_b816_c8749a2c9ded</td>\n",
       "      <td>0.000464</td>\n",
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       "      <th>Ab_sR</th>\n",
       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>6.104391e-26</td>\n",
       "      <td>3.676150e-11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>6.104391e-26</td>\n",
       "      <td>3.676150e-11</td>\n",
       "      <td>-5.097542e-26</td>\n",
       "      <td>-3.069812e-11</td>\n",
       "      <td>Metabolite_95</td>\n",
       "      <td>mw1da111f2_a036_4392_8512_015005bdcbb7</td>\n",
       "      <td>1.185348</td>\n",
       "      <td>Ab_sR{serum}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab_sR_IL6</th>\n",
       "      <td>serum</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>-7.413309e-29</td>\n",
       "      <td>-4.464399e-14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>-7.413309e-29</td>\n",
       "      <td>-4.464399e-14</td>\n",
       "      <td>5.137413e-29</td>\n",
       "      <td>3.093822e-14</td>\n",
       "      <td>Metabolite_96</td>\n",
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       "      <td>1.159408</td>\n",
       "      <td>Ab_sR_IL6{serum}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>CRP Suppression (%)</th>\n",
       "      <td>serum</td>\n",
       "      <td>assignment</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>-0.000000e+00</td>\n",
       "      <td>-0.000000e+00</td>\n",
       "      <td></td>\n",
       "      <td>( [CRP{serum}] - {Values[Initial for CRP]} ) /...</td>\n",
       "      <td>-0.000000e+00</td>\n",
       "      <td>-0.000000e+00</td>\n",
       "      <td>NaN</td>\n",
       "      <td>NaN</td>\n",
       "      <td>Metabolite_97</td>\n",
       "      <td>CRP_Suppression___</td>\n",
       "      <td>NaN</td>\n",
       "      <td>CRP Suppression (%)</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>CRP (% of baseline)</th>\n",
       "      <td>serum</td>\n",
       "      <td>assignment</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.000000e+02</td>\n",
       "      <td>6.022141e+16</td>\n",
       "      <td></td>\n",
       "      <td>[CRP{serum}] / {Values[Initial for CRP]} * 100</td>\n",
       "      <td>1.000000e+02</td>\n",
       "      <td>6.022141e+16</td>\n",
       "      <td>NaN</td>\n",
       "      <td>NaN</td>\n",
       "      <td>Metabolite_98</td>\n",
       "      <td>CRP____of_baseline</td>\n",
       "      <td>NaN</td>\n",
       "      <td>CRP (% of baseline)</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>gp130</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>3.889589e-01</td>\n",
       "      <td>2.342365e+14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>3.889589e-01</td>\n",
       "      <td>2.342365e+14</td>\n",
       "      <td>6.486481e-17</td>\n",
       "      <td>3.906250e-02</td>\n",
       "      <td>Metabolite_99</td>\n",
       "      <td>mw80848184_e2dd_47ce_86d7_7a21479342bd</td>\n",
       "      <td>5.678232</td>\n",
       "      <td>gp130{liver}</td>\n",
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       "    <tr>\n",
       "      <th>R_IL6_gp130</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>6.599359e-05</td>\n",
       "      <td>3.974227e+10</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>6.599359e-05</td>\n",
       "      <td>3.974227e+10</td>\n",
       "      <td>-5.270266e-18</td>\n",
       "      <td>-3.173828e-03</td>\n",
       "      <td>Metabolite_100</td>\n",
       "      <td>mwd2d9d93a_3bd1_4f17_bac1_baba9ef2d55a</td>\n",
       "      <td>0.006371</td>\n",
       "      <td>R_IL6_gp130{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sR_IL6</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>9.761649e-04</td>\n",
       "      <td>5.878603e+11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>9.761649e-04</td>\n",
       "      <td>5.878603e+11</td>\n",
       "      <td>-2.918916e-16</td>\n",
       "      <td>-1.757812e-01</td>\n",
       "      <td>Metabolite_101</td>\n",
       "      <td>mw4638f126_8cb8_4021_ab41_6ae195743ba0</td>\n",
       "      <td>0.123541</td>\n",
       "      <td>sR_IL6{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>R</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>4.382358e-01</td>\n",
       "      <td>2.639118e+14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>4.382358e-01</td>\n",
       "      <td>2.639118e+14</td>\n",
       "      <td>-6.486481e-17</td>\n",
       "      <td>-3.906250e-02</td>\n",
       "      <td>Metabolite_102</td>\n",
       "      <td>mw10315fa3_6f13_4618_bda8_a8694bd3c374</td>\n",
       "      <td>6.397603</td>\n",
       "      <td>R</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>IL6</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>7.256658e-04</td>\n",
       "      <td>4.370062e+11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>7.256658e-04</td>\n",
       "      <td>4.370062e+11</td>\n",
       "      <td>1.444255e-18</td>\n",
       "      <td>8.697510e-04</td>\n",
       "      <td>Metabolite_103</td>\n",
       "      <td>mw0adf3eb4_a196_4c48_b10d_4e9e9faaf9e1</td>\n",
       "      <td>4.075710</td>\n",
       "      <td>IL6{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>R_IL6</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.600365e-05</td>\n",
       "      <td>9.637625e+09</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>1.600365e-05</td>\n",
       "      <td>9.637625e+09</td>\n",
       "      <td>-6.334454e-21</td>\n",
       "      <td>-3.814697e-06</td>\n",
       "      <td>Metabolite_104</td>\n",
       "      <td>mw7d86cc23_a1af_44c3_bdb9_71e9b1bb2a83</td>\n",
       "      <td>0.175114</td>\n",
       "      <td>R_IL6</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ractive</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>7.654165e-01</td>\n",
       "      <td>4.609446e+14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>7.654165e-01</td>\n",
       "      <td>4.609446e+14</td>\n",
       "      <td>2.432430e-18</td>\n",
       "      <td>1.464844e-03</td>\n",
       "      <td>Metabolite_105</td>\n",
       "      <td>mw0eb6c959_d408_45a0_a450_928b8c5876bb</td>\n",
       "      <td>74.828042</td>\n",
       "      <td>Ractive{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>STAT3</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>7.775373e-01</td>\n",
       "      <td>4.682439e+14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>7.775373e-01</td>\n",
       "      <td>4.682439e+14</td>\n",
       "      <td>1.556755e-16</td>\n",
       "      <td>9.375000e-02</td>\n",
       "      <td>Metabolite_106</td>\n",
       "      <td>mw42054cd7_17af_46da_970c_7f99151906ad</td>\n",
       "      <td>1.980238</td>\n",
       "      <td>STAT3{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>pSTAT3</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>9.222463e+00</td>\n",
       "      <td>5.553897e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>9.222463e+00</td>\n",
       "      <td>5.553897e+15</td>\n",
       "      <td>-1.556755e-16</td>\n",
       "      <td>-9.375000e-02</td>\n",
       "      <td>Metabolite_107</td>\n",
       "      <td>mw39c2e431_fdc3_4964_be29_6ca856620b1b</td>\n",
       "      <td>23.487843</td>\n",
       "      <td>pSTAT3{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>CRP</th>\n",
       "      <td>liver</td>\n",
       "      <td>assignment</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.583258e+02</td>\n",
       "      <td>9.534605e+16</td>\n",
       "      <td></td>\n",
       "      <td>Values[VmProtSynth] * [pSTAT3{liver}] / ( Valu...</td>\n",
       "      <td>1.583258e+02</td>\n",
       "      <td>9.534605e+16</td>\n",
       "      <td>NaN</td>\n",
       "      <td>NaN</td>\n",
       "      <td>Metabolite_108</td>\n",
       "      <td>mwd5313618_89eb_4c8c_bc82_66f10f966349</td>\n",
       "      <td>NaN</td>\n",
       "      <td>CRP{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sR</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>6.087047e+00</td>\n",
       "      <td>3.665705e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>6.087047e+00</td>\n",
       "      <td>3.665705e+15</td>\n",
       "      <td>-7.654706e-15</td>\n",
       "      <td>-4.609772e+00</td>\n",
       "      <td>Metabolite_109</td>\n",
       "      <td>mw2e464cf3_a09c_4b7c_9f3c_06720016a48e</td>\n",
       "      <td>34187.965404</td>\n",
       "      <td>sR{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>CRPExtracellular</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>4.097753e+02</td>\n",
       "      <td>2.467725e+17</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>4.097753e+02</td>\n",
       "      <td>2.467725e+17</td>\n",
       "      <td>-5.048039e-13</td>\n",
       "      <td>-3.040000e+02</td>\n",
       "      <td>Metabolite_110</td>\n",
       "      <td>mw36ea78c1_ed71_4def_96d3_857a442d7195</td>\n",
       "      <td>5.176354</td>\n",
       "      <td>CRPExtracellular</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sgp130</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>5.589699e+00</td>\n",
       "      <td>3.366195e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>5.589699e+00</td>\n",
       "      <td>3.366195e+15</td>\n",
       "      <td>3.468646e-15</td>\n",
       "      <td>2.088867e+00</td>\n",
       "      <td>Metabolite_111</td>\n",
       "      <td>mw147d30ec_478e_4090_b496_128a131d29eb</td>\n",
       "      <td>755.173729</td>\n",
       "      <td>sgp130{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sR_IL6_sgp130</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.163437e-01</td>\n",
       "      <td>7.006379e+13</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>1.163437e-01</td>\n",
       "      <td>7.006379e+13</td>\n",
       "      <td>5.416211e-16</td>\n",
       "      <td>3.261719e-01</td>\n",
       "      <td>Metabolite_112</td>\n",
       "      <td>mwab41493c_6349_45f1_a226_3030cfed0e06</td>\n",
       "      <td>15.718141</td>\n",
       "      <td>sR_IL6_sgp130{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab_sR</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>8.616193e-26</td>\n",
       "      <td>5.188793e-11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>8.616193e-26</td>\n",
       "      <td>5.188793e-11</td>\n",
       "      <td>-8.215556e-26</td>\n",
       "      <td>-4.947523e-11</td>\n",
       "      <td>Metabolite_113</td>\n",
       "      <td>mwf405687b_7401_44ec_a0d6_4a2b35c13e8a</td>\n",
       "      <td>1.048766</td>\n",
       "      <td>Ab_sR{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>2.200207e-29</td>\n",
       "      <td>1.324996e-14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>2.200207e-29</td>\n",
       "      <td>1.324996e-14</td>\n",
       "      <td>7.691938e-26</td>\n",
       "      <td>4.632193e-11</td>\n",
       "      <td>Metabolite_114</td>\n",
       "      <td>mw3667a5e1_02c9_44a0_acb4_b0431faa822d</td>\n",
       "      <td>0.000270</td>\n",
       "      <td>Ab{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab_R</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>2.033720e-27</td>\n",
       "      <td>1.224735e-12</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>2.033720e-27</td>\n",
       "      <td>1.224735e-12</td>\n",
       "      <td>4.554136e-27</td>\n",
       "      <td>2.742565e-12</td>\n",
       "      <td>Metabolite_115</td>\n",
       "      <td>mw772cbf20_3fc1_4800_ae59_77884f1ae333</td>\n",
       "      <td>0.446207</td>\n",
       "      <td>Ab_R</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab_sR_IL6</th>\n",
       "      <td>liver</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>-3.077935e-29</td>\n",
       "      <td>-1.853576e-14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>-3.077935e-29</td>\n",
       "      <td>-1.853576e-14</td>\n",
       "      <td>-6.375163e-29</td>\n",
       "      <td>-3.839213e-14</td>\n",
       "      <td>Metabolite_116</td>\n",
       "      <td>mw2ba2b802_9f07_4f4d_94c6_24c8de1a95cf</td>\n",
       "      <td>0.482382</td>\n",
       "      <td>Ab_sR_IL6{liver}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sR_IL6</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.306824e-03</td>\n",
       "      <td>7.869877e+11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>1.306824e-03</td>\n",
       "      <td>7.869877e+11</td>\n",
       "      <td>1.281080e-16</td>\n",
       "      <td>7.714844e-02</td>\n",
       "      <td>Metabolite_117</td>\n",
       "      <td>mw7becb5fe_8da8_4285_a821_0d77ad811b62</td>\n",
       "      <td>0.067090</td>\n",
       "      <td>sR_IL6{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>gp130</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>3.749627e-01</td>\n",
       "      <td>2.258078e+14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>3.749627e-01</td>\n",
       "      <td>2.258078e+14</td>\n",
       "      <td>6.486481e-17</td>\n",
       "      <td>3.906250e-02</td>\n",
       "      <td>Metabolite_118</td>\n",
       "      <td>mw8c9107e6_f51d_442d_b2dc_2bfdbb8482ca</td>\n",
       "      <td>5.473908</td>\n",
       "      <td>gp130{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>R_IL6_gp130</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>8.448905e-05</td>\n",
       "      <td>5.088050e+10</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>8.448905e-05</td>\n",
       "      <td>5.088050e+10</td>\n",
       "      <td>-2.997464e-17</td>\n",
       "      <td>-1.805115e-02</td>\n",
       "      <td>Metabolite_119</td>\n",
       "      <td>mw824bc3d4_1ac3_4912_9b51_8f14ff1c96b9</td>\n",
       "      <td>0.006371</td>\n",
       "      <td>R_IL6_gp130{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ractive</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>9.802725e-01</td>\n",
       "      <td>5.903339e+14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>9.802725e-01</td>\n",
       "      <td>5.903339e+14</td>\n",
       "      <td>1.135134e-17</td>\n",
       "      <td>6.835938e-03</td>\n",
       "      <td>Metabolite_120</td>\n",
       "      <td>mw6cce2109_0e32_4dd9_98ec_41173e8ef07d</td>\n",
       "      <td>74.853946</td>\n",
       "      <td>Ractive{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>STAT3</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>6.106360e-01</td>\n",
       "      <td>3.677336e+14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>6.106360e-01</td>\n",
       "      <td>3.677336e+14</td>\n",
       "      <td>-1.037837e-16</td>\n",
       "      <td>-6.250000e-02</td>\n",
       "      <td>Metabolite_121</td>\n",
       "      <td>mw2b255f94_8018_4b99_bde8_918eeac45446</td>\n",
       "      <td>1.545036</td>\n",
       "      <td>STAT3{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>pSTAT3</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>9.389364e+00</td>\n",
       "      <td>5.654407e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>9.389364e+00</td>\n",
       "      <td>5.654407e+15</td>\n",
       "      <td>1.037837e-16</td>\n",
       "      <td>6.250000e-02</td>\n",
       "      <td>Metabolite_122</td>\n",
       "      <td>mw48867e93_f170_44e8_ac7a_185b23e1bf3b</td>\n",
       "      <td>23.757039</td>\n",
       "      <td>pSTAT3{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>geneProduct</th>\n",
       "      <td>gut</td>\n",
       "      <td>assignment</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.598036e+02</td>\n",
       "      <td>9.623598e+16</td>\n",
       "      <td></td>\n",
       "      <td>Values[VmProtSynth] * [pSTAT3{gut}] / ( Values...</td>\n",
       "      <td>1.598036e+02</td>\n",
       "      <td>9.623598e+16</td>\n",
       "      <td>NaN</td>\n",
       "      <td>NaN</td>\n",
       "      <td>Metabolite_123</td>\n",
       "      <td>mw0083d743_836f_4238_a17f_4602193d5bc0</td>\n",
       "      <td>NaN</td>\n",
       "      <td>geneProduct</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sR</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>6.064107e+00</td>\n",
       "      <td>3.651890e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>6.064107e+00</td>\n",
       "      <td>3.651890e+15</td>\n",
       "      <td>-5.510265e-15</td>\n",
       "      <td>-3.318359e+00</td>\n",
       "      <td>Metabolite_124</td>\n",
       "      <td>mwd31f52cc_04e7_40e0_885f_c7b2d9e62215</td>\n",
       "      <td>314.866866</td>\n",
       "      <td>sR{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>IL6</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>9.348199e-03</td>\n",
       "      <td>5.629617e+12</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>9.348199e-03</td>\n",
       "      <td>5.629617e+12</td>\n",
       "      <td>0.000000e+00</td>\n",
       "      <td>0.000000e+00</td>\n",
       "      <td>Metabolite_125</td>\n",
       "      <td>mw2c9b0499_3325_4394_8af3_bbf653a944a0</td>\n",
       "      <td>0.259672</td>\n",
       "      <td>IL6{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sgp130</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>5.569739e+00</td>\n",
       "      <td>3.354175e+15</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>5.569739e+00</td>\n",
       "      <td>3.354175e+15</td>\n",
       "      <td>-3.747564e-15</td>\n",
       "      <td>-2.256836e+00</td>\n",
       "      <td>Metabolite_126</td>\n",
       "      <td>mwd65b5b39_dc1b_4e77_a999_67277a880e5e</td>\n",
       "      <td>585.644296</td>\n",
       "      <td>sgp130{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>sR_IL6_sgp130</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.363039e-01</td>\n",
       "      <td>8.208413e+13</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>1.363039e-01</td>\n",
       "      <td>8.208413e+13</td>\n",
       "      <td>-1.654053e-16</td>\n",
       "      <td>-9.960938e-02</td>\n",
       "      <td>Metabolite_127</td>\n",
       "      <td>mw6335d5d7_c7b0_4bc0_b883_f7ee4915c2c3</td>\n",
       "      <td>14.332020</td>\n",
       "      <td>sR_IL6_sgp130{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>2.158790e-29</td>\n",
       "      <td>1.300053e-14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>2.158790e-29</td>\n",
       "      <td>1.300053e-14</td>\n",
       "      <td>-6.539663e-26</td>\n",
       "      <td>-3.938277e-11</td>\n",
       "      <td>Metabolite_128</td>\n",
       "      <td>mwf7796221_1fea_4274_a93e_c00adbf5778c</td>\n",
       "      <td>0.000330</td>\n",
       "      <td>Ab{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab_sR</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>2.620597e-26</td>\n",
       "      <td>1.578160e-11</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>2.620597e-26</td>\n",
       "      <td>1.578160e-11</td>\n",
       "      <td>6.543913e-26</td>\n",
       "      <td>3.940837e-11</td>\n",
       "      <td>Metabolite_129</td>\n",
       "      <td>mw5d764bb8_5693_4ac8_9557_f65992cc5eb0</td>\n",
       "      <td>0.400175</td>\n",
       "      <td>Ab_sR{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab_sR_IL6</th>\n",
       "      <td>gut</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>-1.209167e-28</td>\n",
       "      <td>-7.281774e-14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>-1.209167e-28</td>\n",
       "      <td>-7.281774e-14</td>\n",
       "      <td>1.278399e-29</td>\n",
       "      <td>7.698701e-15</td>\n",
       "      <td>Metabolite_130</td>\n",
       "      <td>mwedc1bc00_adf7_4144_a1c2_7dc1a9565dc2</td>\n",
       "      <td>9.458444</td>\n",
       "      <td>Ab_sR_IL6{gut}</td>\n",
       "    </tr>\n",
       "    <tr>\n",
       "      <th>Ab</th>\n",
       "      <td>peripheral</td>\n",
       "      <td>reactions</td>\n",
       "      <td>nmol/l</td>\n",
       "      <td>1.679209e-29</td>\n",
       "      <td>1.011244e-14</td>\n",
       "      <td></td>\n",
       "      <td></td>\n",
       "      <td>1.679209e-29</td>\n",
       "      <td>1.011244e-14</td>\n",
       "      <td>-2.088274e-32</td>\n",
       "      <td>-1.257588e-17</td>\n",
       "      <td>Metabolite_131</td>\n",
       "      <td>mwbc2f5464_81e5_43fd_8b39_f5a2756af72f</td>\n",
       "      <td>804.113764</td>\n",
       "      <td>Ab{peripheral}</td>\n",
       "    </tr>\n",
       "  </tbody>\n",
       "</table>\n",
       "</div>"
      ],
      "text/plain": [
       "                    compartment        type    unit  initial_concentration  \\\n",
       "name                                                                         \n",
       "IL6                       serum   reactions  nmol/l           4.356289e-04   \n",
       "sgp130                    serum   reactions  nmol/l           3.900000e+00   \n",
       "sR_IL6_sgp130             serum   reactions  nmol/l           8.740607e-02   \n",
       "CRP                       serum   reactions  nmol/l           2.210637e+02   \n",
       "sR                        serum   reactions  nmol/l           4.253507e+00   \n",
       "sR_IL6                    serum   reactions  nmol/l           1.094243e-03   \n",
       "Ab                        serum   reactions  nmol/l           2.381820e-29   \n",
       "Ab_sR                     serum   reactions  nmol/l           6.104391e-26   \n",
       "Ab_sR_IL6                 serum   reactions  nmol/l          -7.413309e-29   \n",
       "CRP Suppression (%)       serum  assignment  nmol/l          -0.000000e+00   \n",
       "CRP (% of baseline)       serum  assignment  nmol/l           1.000000e+02   \n",
       "gp130                     liver   reactions  nmol/l           3.889589e-01   \n",
       "R_IL6_gp130               liver   reactions  nmol/l           6.599359e-05   \n",
       "sR_IL6                    liver   reactions  nmol/l           9.761649e-04   \n",
       "R                         liver   reactions  nmol/l           4.382358e-01   \n",
       "IL6                       liver   reactions  nmol/l           7.256658e-04   \n",
       "R_IL6                     liver   reactions  nmol/l           1.600365e-05   \n",
       "Ractive                   liver   reactions  nmol/l           7.654165e-01   \n",
       "STAT3                     liver   reactions  nmol/l           7.775373e-01   \n",
       "pSTAT3                    liver   reactions  nmol/l           9.222463e+00   \n",
       "CRP                       liver  assignment  nmol/l           1.583258e+02   \n",
       "sR                        liver   reactions  nmol/l           6.087047e+00   \n",
       "CRPExtracellular          liver   reactions  nmol/l           4.097753e+02   \n",
       "sgp130                    liver   reactions  nmol/l           5.589699e+00   \n",
       "sR_IL6_sgp130             liver   reactions  nmol/l           1.163437e-01   \n",
       "Ab_sR                     liver   reactions  nmol/l           8.616193e-26   \n",
       "Ab                        liver   reactions  nmol/l           2.200207e-29   \n",
       "Ab_R                      liver   reactions  nmol/l           2.033720e-27   \n",
       "Ab_sR_IL6                 liver   reactions  nmol/l          -3.077935e-29   \n",
       "sR_IL6                      gut   reactions  nmol/l           1.306824e-03   \n",
       "gp130                       gut   reactions  nmol/l           3.749627e-01   \n",
       "R_IL6_gp130                 gut   reactions  nmol/l           8.448905e-05   \n",
       "Ractive                     gut   reactions  nmol/l           9.802725e-01   \n",
       "STAT3                       gut   reactions  nmol/l           6.106360e-01   \n",
       "pSTAT3                      gut   reactions  nmol/l           9.389364e+00   \n",
       "geneProduct                 gut  assignment  nmol/l           1.598036e+02   \n",
       "sR                          gut   reactions  nmol/l           6.064107e+00   \n",
       "IL6                         gut   reactions  nmol/l           9.348199e-03   \n",
       "sgp130                      gut   reactions  nmol/l           5.569739e+00   \n",
       "sR_IL6_sgp130               gut   reactions  nmol/l           1.363039e-01   \n",
       "Ab                          gut   reactions  nmol/l           2.158790e-29   \n",
       "Ab_sR                       gut   reactions  nmol/l           2.620597e-26   \n",
       "Ab_sR_IL6                   gut   reactions  nmol/l          -1.209167e-28   \n",
       "Ab                   peripheral   reactions  nmol/l           1.679209e-29   \n",
       "\n",
       "                     initial_particle_number initial_expression  \\\n",
       "name                                                              \n",
       "IL6                             2.623419e+11                      \n",
       "sgp130                          2.348635e+15                      \n",
       "sR_IL6_sgp130                   5.263716e+13                      \n",
       "CRP                             1.331277e+17                      \n",
       "sR                              2.561522e+15                      \n",
       "sR_IL6                          6.589683e+11                      \n",
       "Ab                              1.434365e-14                      \n",
       "Ab_sR                           3.676150e-11                      \n",
       "Ab_sR_IL6                      -4.464399e-14                      \n",
       "CRP Suppression (%)            -0.000000e+00                      \n",
       "CRP (% of baseline)             6.022141e+16                      \n",
       "gp130                           2.342365e+14                      \n",
       "R_IL6_gp130                     3.974227e+10                      \n",
       "sR_IL6                          5.878603e+11                      \n",
       "R                               2.639118e+14                      \n",
       "IL6                             4.370062e+11                      \n",
       "R_IL6                           9.637625e+09                      \n",
       "Ractive                         4.609446e+14                      \n",
       "STAT3                           4.682439e+14                      \n",
       "pSTAT3                          5.553897e+15                      \n",
       "CRP                             9.534605e+16                      \n",
       "sR                              3.665705e+15                      \n",
       "CRPExtracellular                2.467725e+17                      \n",
       "sgp130                          3.366195e+15                      \n",
       "sR_IL6_sgp130                   7.006379e+13                      \n",
       "Ab_sR                           5.188793e-11                      \n",
       "Ab                              1.324996e-14                      \n",
       "Ab_R                            1.224735e-12                      \n",
       "Ab_sR_IL6                      -1.853576e-14                      \n",
       "sR_IL6                          7.869877e+11                      \n",
       "gp130                           2.258078e+14                      \n",
       "R_IL6_gp130                     5.088050e+10                      \n",
       "Ractive                         5.903339e+14                      \n",
       "STAT3                           3.677336e+14                      \n",
       "pSTAT3                          5.654407e+15                      \n",
       "geneProduct                     9.623598e+16                      \n",
       "sR                              3.651890e+15                      \n",
       "IL6                             5.629617e+12                      \n",
       "sgp130                          3.354175e+15                      \n",
       "sR_IL6_sgp130                   8.208413e+13                      \n",
       "Ab                              1.300053e-14                      \n",
       "Ab_sR                           1.578160e-11                      \n",
       "Ab_sR_IL6                      -7.281774e-14                      \n",
       "Ab                              1.011244e-14                      \n",
       "\n",
       "                                                            expression  \\\n",
       "name                                                                     \n",
       "IL6                                                                      \n",
       "sgp130                                                                   \n",
       "sR_IL6_sgp130                                                            \n",
       "CRP                                                                      \n",
       "sR                                                                       \n",
       "sR_IL6                                                                   \n",
       "Ab                                                                       \n",
       "Ab_sR                                                                    \n",
       "Ab_sR_IL6                                                                \n",
       "CRP Suppression (%)  ( [CRP{serum}] - {Values[Initial for CRP]} ) /...   \n",
       "CRP (% of baseline)     [CRP{serum}] / {Values[Initial for CRP]} * 100   \n",
       "gp130                                                                    \n",
       "R_IL6_gp130                                                              \n",
       "sR_IL6                                                                   \n",
       "R                                                                        \n",
       "IL6                                                                      \n",
       "R_IL6                                                                    \n",
       "Ractive                                                                  \n",
       "STAT3                                                                    \n",
       "pSTAT3                                                                   \n",
       "CRP                  Values[VmProtSynth] * [pSTAT3{liver}] / ( Valu...   \n",
       "sR                                                                       \n",
       "CRPExtracellular                                                         \n",
       "sgp130                                                                   \n",
       "sR_IL6_sgp130                                                            \n",
       "Ab_sR                                                                    \n",
       "Ab                                                                       \n",
       "Ab_R                                                                     \n",
       "Ab_sR_IL6                                                                \n",
       "sR_IL6                                                                   \n",
       "gp130                                                                    \n",
       "R_IL6_gp130                                                              \n",
       "Ractive                                                                  \n",
       "STAT3                                                                    \n",
       "pSTAT3                                                                   \n",
       "geneProduct          Values[VmProtSynth] * [pSTAT3{gut}] / ( Values...   \n",
       "sR                                                                       \n",
       "IL6                                                                      \n",
       "sgp130                                                                   \n",
       "sR_IL6_sgp130                                                            \n",
       "Ab                                                                       \n",
       "Ab_sR                                                                    \n",
       "Ab_sR_IL6                                                                \n",
       "Ab                                                                       \n",
       "\n",
       "                     concentration  particle_number          rate  \\\n",
       "name                                                                \n",
       "IL6                   4.356289e-04     2.623419e+11 -1.565877e-17   \n",
       "sgp130                3.900000e+00     2.348635e+15  0.000000e+00   \n",
       "sR_IL6_sgp130         8.740607e-02     5.263716e+13 -2.367565e-16   \n",
       "CRP                   2.210637e+02     1.331277e+17  6.243627e-13   \n",
       "sR                    4.253507e+00     2.561522e+15  1.307675e-14   \n",
       "sR_IL6                1.094243e-03     6.589683e+11  5.032090e-17   \n",
       "Ab                    2.381820e-29     1.434365e-14  5.129906e-26   \n",
       "Ab_sR                 6.104391e-26     3.676150e-11 -5.097542e-26   \n",
       "Ab_sR_IL6            -7.413309e-29    -4.464399e-14  5.137413e-29   \n",
       "CRP Suppression (%)  -0.000000e+00    -0.000000e+00           NaN   \n",
       "CRP (% of baseline)   1.000000e+02     6.022141e+16           NaN   \n",
       "gp130                 3.889589e-01     2.342365e+14  6.486481e-17   \n",
       "R_IL6_gp130           6.599359e-05     3.974227e+10 -5.270266e-18   \n",
       "sR_IL6                9.761649e-04     5.878603e+11 -2.918916e-16   \n",
       "R                     4.382358e-01     2.639118e+14 -6.486481e-17   \n",
       "IL6                   7.256658e-04     4.370062e+11  1.444255e-18   \n",
       "R_IL6                 1.600365e-05     9.637625e+09 -6.334454e-21   \n",
       "Ractive               7.654165e-01     4.609446e+14  2.432430e-18   \n",
       "STAT3                 7.775373e-01     4.682439e+14  1.556755e-16   \n",
       "pSTAT3                9.222463e+00     5.553897e+15 -1.556755e-16   \n",
       "CRP                   1.583258e+02     9.534605e+16           NaN   \n",
       "sR                    6.087047e+00     3.665705e+15 -7.654706e-15   \n",
       "CRPExtracellular      4.097753e+02     2.467725e+17 -5.048039e-13   \n",
       "sgp130                5.589699e+00     3.366195e+15  3.468646e-15   \n",
       "sR_IL6_sgp130         1.163437e-01     7.006379e+13  5.416211e-16   \n",
       "Ab_sR                 8.616193e-26     5.188793e-11 -8.215556e-26   \n",
       "Ab                    2.200207e-29     1.324996e-14  7.691938e-26   \n",
       "Ab_R                  2.033720e-27     1.224735e-12  4.554136e-27   \n",
       "Ab_sR_IL6            -3.077935e-29    -1.853576e-14 -6.375163e-29   \n",
       "sR_IL6                1.306824e-03     7.869877e+11  1.281080e-16   \n",
       "gp130                 3.749627e-01     2.258078e+14  6.486481e-17   \n",
       "R_IL6_gp130           8.448905e-05     5.088050e+10 -2.997464e-17   \n",
       "Ractive               9.802725e-01     5.903339e+14  1.135134e-17   \n",
       "STAT3                 6.106360e-01     3.677336e+14 -1.037837e-16   \n",
       "pSTAT3                9.389364e+00     5.654407e+15  1.037837e-16   \n",
       "geneProduct           1.598036e+02     9.623598e+16           NaN   \n",
       "sR                    6.064107e+00     3.651890e+15 -5.510265e-15   \n",
       "IL6                   9.348199e-03     5.629617e+12  0.000000e+00   \n",
       "sgp130                5.569739e+00     3.354175e+15 -3.747564e-15   \n",
       "sR_IL6_sgp130         1.363039e-01     8.208413e+13 -1.654053e-16   \n",
       "Ab                    2.158790e-29     1.300053e-14 -6.539663e-26   \n",
       "Ab_sR                 2.620597e-26     1.578160e-11  6.543913e-26   \n",
       "Ab_sR_IL6            -1.209167e-28    -7.281774e-14  1.278399e-29   \n",
       "Ab                    1.679209e-29     1.011244e-14 -2.088274e-32   \n",
       "\n",
       "                     particle_number_rate             key  \\\n",
       "name                                                        \n",
       "IL6                         -9.429932e-03   Metabolite_88   \n",
       "sgp130                       0.000000e+00   Metabolite_89   \n",
       "sR_IL6_sgp130               -1.425781e-01   Metabolite_90   \n",
       "CRP                          3.760000e+02   Metabolite_91   \n",
       "sR                           7.875000e+00   Metabolite_92   \n",
       "sR_IL6                       3.030396e-02   Metabolite_93   \n",
       "Ab                           3.089302e-11   Metabolite_94   \n",
       "Ab_sR                       -3.069812e-11   Metabolite_95   \n",
       "Ab_sR_IL6                    3.093822e-14   Metabolite_96   \n",
       "CRP Suppression (%)                   NaN   Metabolite_97   \n",
       "CRP (% of baseline)                   NaN   Metabolite_98   \n",
       "gp130                        3.906250e-02   Metabolite_99   \n",
       "R_IL6_gp130                 -3.173828e-03  Metabolite_100   \n",
       "sR_IL6                      -1.757812e-01  Metabolite_101   \n",
       "R                           -3.906250e-02  Metabolite_102   \n",
       "IL6                          8.697510e-04  Metabolite_103   \n",
       "R_IL6                       -3.814697e-06  Metabolite_104   \n",
       "Ractive                      1.464844e-03  Metabolite_105   \n",
       "STAT3                        9.375000e-02  Metabolite_106   \n",
       "pSTAT3                      -9.375000e-02  Metabolite_107   \n",
       "CRP                                   NaN  Metabolite_108   \n",
       "sR                          -4.609772e+00  Metabolite_109   \n",
       "CRPExtracellular            -3.040000e+02  Metabolite_110   \n",
       "sgp130                       2.088867e+00  Metabolite_111   \n",
       "sR_IL6_sgp130                3.261719e-01  Metabolite_112   \n",
       "Ab_sR                       -4.947523e-11  Metabolite_113   \n",
       "Ab                           4.632193e-11  Metabolite_114   \n",
       "Ab_R                         2.742565e-12  Metabolite_115   \n",
       "Ab_sR_IL6                   -3.839213e-14  Metabolite_116   \n",
       "sR_IL6                       7.714844e-02  Metabolite_117   \n",
       "gp130                        3.906250e-02  Metabolite_118   \n",
       "R_IL6_gp130                 -1.805115e-02  Metabolite_119   \n",
       "Ractive                      6.835938e-03  Metabolite_120   \n",
       "STAT3                       -6.250000e-02  Metabolite_121   \n",
       "pSTAT3                       6.250000e-02  Metabolite_122   \n",
       "geneProduct                           NaN  Metabolite_123   \n",
       "sR                          -3.318359e+00  Metabolite_124   \n",
       "IL6                          0.000000e+00  Metabolite_125   \n",
       "sgp130                      -2.256836e+00  Metabolite_126   \n",
       "sR_IL6_sgp130               -9.960938e-02  Metabolite_127   \n",
       "Ab                          -3.938277e-11  Metabolite_128   \n",
       "Ab_sR                        3.940837e-11  Metabolite_129   \n",
       "Ab_sR_IL6                    7.698701e-15  Metabolite_130   \n",
       "Ab                          -1.257588e-17  Metabolite_131   \n",
       "\n",
       "                                                    sbml_id  transition_time  \\\n",
       "name                                                                           \n",
       "IL6                  mwf626e95e_543f_41e4_aad4_c6bf60ab345b         0.028719   \n",
       "sgp130               mwbbbce920_e8dd_4320_9386_fc94bfb2fc99         0.997567   \n",
       "sR_IL6_sgp130        mw810ff751_fa4e_4143_bd50_169b3e325e1e         9.190533   \n",
       "CRP                  mw114aa90f_5f5b_4fe8_9406_361c8489b6a1         2.777778   \n",
       "sR                   mw30ae63db_6cd3_4b6f_93ad_3350cd360bcc         3.283772   \n",
       "sR_IL6               mw03db56ac_8dc6_4931_ae82_fef706d2ee3d         0.518949   \n",
       "Ab                   mwf345ed7a_0622_403c_b816_c8749a2c9ded         0.000464   \n",
       "Ab_sR                mw1da111f2_a036_4392_8512_015005bdcbb7         1.185348   \n",
       "Ab_sR_IL6            mw9947742a_0e4b_4636_9a4b_b6eef2a8f6ac         1.159408   \n",
       "CRP Suppression (%)                      CRP_Suppression___              NaN   \n",
       "CRP (% of baseline)                      CRP____of_baseline              NaN   \n",
       "gp130                mw80848184_e2dd_47ce_86d7_7a21479342bd         5.678232   \n",
       "R_IL6_gp130          mwd2d9d93a_3bd1_4f17_bac1_baba9ef2d55a         0.006371   \n",
       "sR_IL6               mw4638f126_8cb8_4021_ab41_6ae195743ba0         0.123541   \n",
       "R                    mw10315fa3_6f13_4618_bda8_a8694bd3c374         6.397603   \n",
       "IL6                  mw0adf3eb4_a196_4c48_b10d_4e9e9faaf9e1         4.075710   \n",
       "R_IL6                mw7d86cc23_a1af_44c3_bdb9_71e9b1bb2a83         0.175114   \n",
       "Ractive              mw0eb6c959_d408_45a0_a450_928b8c5876bb        74.828042   \n",
       "STAT3                mw42054cd7_17af_46da_970c_7f99151906ad         1.980238   \n",
       "pSTAT3               mw39c2e431_fdc3_4964_be29_6ca856620b1b        23.487843   \n",
       "CRP                  mwd5313618_89eb_4c8c_bc82_66f10f966349              NaN   \n",
       "sR                   mw2e464cf3_a09c_4b7c_9f3c_06720016a48e     34187.965404   \n",
       "CRPExtracellular     mw36ea78c1_ed71_4def_96d3_857a442d7195         5.176354   \n",
       "sgp130               mw147d30ec_478e_4090_b496_128a131d29eb       755.173729   \n",
       "sR_IL6_sgp130        mwab41493c_6349_45f1_a226_3030cfed0e06        15.718141   \n",
       "Ab_sR                mwf405687b_7401_44ec_a0d6_4a2b35c13e8a         1.048766   \n",
       "Ab                   mw3667a5e1_02c9_44a0_acb4_b0431faa822d         0.000270   \n",
       "Ab_R                 mw772cbf20_3fc1_4800_ae59_77884f1ae333         0.446207   \n",
       "Ab_sR_IL6            mw2ba2b802_9f07_4f4d_94c6_24c8de1a95cf         0.482382   \n",
       "sR_IL6               mw7becb5fe_8da8_4285_a821_0d77ad811b62         0.067090   \n",
       "gp130                mw8c9107e6_f51d_442d_b2dc_2bfdbb8482ca         5.473908   \n",
       "R_IL6_gp130          mw824bc3d4_1ac3_4912_9b51_8f14ff1c96b9         0.006371   \n",
       "Ractive              mw6cce2109_0e32_4dd9_98ec_41173e8ef07d        74.853946   \n",
       "STAT3                mw2b255f94_8018_4b99_bde8_918eeac45446         1.545036   \n",
       "pSTAT3               mw48867e93_f170_44e8_ac7a_185b23e1bf3b        23.757039   \n",
       "geneProduct          mw0083d743_836f_4238_a17f_4602193d5bc0              NaN   \n",
       "sR                   mwd31f52cc_04e7_40e0_885f_c7b2d9e62215       314.866866   \n",
       "IL6                  mw2c9b0499_3325_4394_8af3_bbf653a944a0         0.259672   \n",
       "sgp130               mwd65b5b39_dc1b_4e77_a999_67277a880e5e       585.644296   \n",
       "sR_IL6_sgp130        mw6335d5d7_c7b0_4bc0_b883_f7ee4915c2c3        14.332020   \n",
       "Ab                   mwf7796221_1fea_4274_a93e_c00adbf5778c         0.000330   \n",
       "Ab_sR                mw5d764bb8_5693_4ac8_9557_f65992cc5eb0         0.400175   \n",
       "Ab_sR_IL6            mwedc1bc00_adf7_4144_a1c2_7dc1a9565dc2         9.458444   \n",
       "Ab                   mwbc2f5464_81e5_43fd_8b39_f5a2756af72f       804.113764   \n",
       "\n",
       "                             display_name  \n",
       "name                                       \n",
       "IL6                            IL6{serum}  \n",
       "sgp130                      sgp130{serum}  \n",
       "sR_IL6_sgp130        sR_IL6_sgp130{serum}  \n",
       "CRP                            CRP{serum}  \n",
       "sR                              sR{serum}  \n",
       "sR_IL6                      sR_IL6{serum}  \n",
       "Ab                              Ab{serum}  \n",
       "Ab_sR                        Ab_sR{serum}  \n",
       "Ab_sR_IL6                Ab_sR_IL6{serum}  \n",
       "CRP Suppression (%)   CRP Suppression (%)  \n",
       "CRP (% of baseline)   CRP (% of baseline)  \n",
       "gp130                        gp130{liver}  \n",
       "R_IL6_gp130            R_IL6_gp130{liver}  \n",
       "sR_IL6                      sR_IL6{liver}  \n",
       "R                                       R  \n",
       "IL6                            IL6{liver}  \n",
       "R_IL6                               R_IL6  \n",
       "Ractive                    Ractive{liver}  \n",
       "STAT3                        STAT3{liver}  \n",
       "pSTAT3                      pSTAT3{liver}  \n",
       "CRP                            CRP{liver}  \n",
       "sR                              sR{liver}  \n",
       "CRPExtracellular         CRPExtracellular  \n",
       "sgp130                      sgp130{liver}  \n",
       "sR_IL6_sgp130        sR_IL6_sgp130{liver}  \n",
       "Ab_sR                        Ab_sR{liver}  \n",
       "Ab                              Ab{liver}  \n",
       "Ab_R                                 Ab_R  \n",
       "Ab_sR_IL6                Ab_sR_IL6{liver}  \n",
       "sR_IL6                        sR_IL6{gut}  \n",
       "gp130                          gp130{gut}  \n",
       "R_IL6_gp130              R_IL6_gp130{gut}  \n",
       "Ractive                      Ractive{gut}  \n",
       "STAT3                          STAT3{gut}  \n",
       "pSTAT3                        pSTAT3{gut}  \n",
       "geneProduct                   geneProduct  \n",
       "sR                                sR{gut}  \n",
       "IL6                              IL6{gut}  \n",
       "sgp130                        sgp130{gut}  \n",
       "sR_IL6_sgp130          sR_IL6_sgp130{gut}  \n",
       "Ab                                Ab{gut}  \n",
       "Ab_sR                          Ab_sR{gut}  \n",
       "Ab_sR_IL6                  Ab_sR_IL6{gut}  \n",
       "Ab                         Ab{peripheral}  "
      ]
     },
     "execution_count": 10,
     "metadata": {},
     "output_type": "execute_result"
    }
   ],
   "source": [
    "# get model species\n",
    "species = basico.get_species()\n",
    "species"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 11,
   "metadata": {},
   "outputs": [
    {
     "data": {
      "text/plain": [
       "{'descriptions': [{'id': '3569',\n",
       "   'qualifier': 'is version of',\n",
       "   'uri': 'http://identifiers.org/ncbigene/3569',\n",
       "   'resource': 'NCBI Gene'},\n",
       "  {'id': 'P05231',\n",
       "   'qualifier': 'is version of',\n",
       "   'uri': 'http://identifiers.org/uniprot/P05231',\n",
       "   'resource': 'UniProt Knowledgebase'},\n",
       "  {'id': 'BTO:0001239',\n",
       "   'qualifier': 'is version of',\n",
       "   'uri': 'http://identifiers.org/BTO:0001239',\n",
       "   'resource': 'Brenda Tissue Ontology'}]}"
      ]
     },
     "execution_count": 11,
     "metadata": {},
     "output_type": "execute_result"
    }
   ],
   "source": [
    "# get annotations\n",
    "basico.get_miriam_annotation(name=\"IL6\")"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": null,
   "metadata": {},
   "outputs": [],
   "source": []
  }
 ],
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