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2 changes: 1 addition & 1 deletion models/4or2_final/4or2_final_meta.json
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Expand Up @@ -385220,7 +385220,7 @@
"_direction": null
}
},
"pref_name": "mGluR1",
"pref_name": "Metabotropic glutamate receptor 1 (mGluR1)",
"case_study": "pd",
"estimator": "./4or2_final/4or2_final.json"
}
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2 changes: 1 addition & 1 deletion models/8t6j_b_final/8t6j_b_final_meta.json
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Expand Up @@ -1720922,7 +1720922,7 @@
"_direction": null
}
},
"pref_name": "mGluR5",
"pref_name": "Metabotropic glutamate receptor 5 (mGluR5)",
"case_study": "pd",
"estimator": "./8t6j_b_final/8t6j_b_final.json"
}
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2 changes: 1 addition & 1 deletion models/P31644_RF_Model/P31644_RF_Model_meta.json
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Expand Up @@ -4145,7 +4145,7 @@
"alg": "sklearn.ensemble._forest.RandomForestRegressor",
"randomState": 2,
"pref_name": "GABA",
"case_study": "pd",
"case_study": "archived",
"estimator": "./P31644_RF_Model/P31644_RF_Model.json"
}
}
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Expand Up @@ -4145,7 +4145,7 @@
"alg": "sklearn.ensemble._forest.RandomForestRegressor",
"randomState": 2,
"pref_name": "mGLU 5 Allosteric",
"case_study": "pd",
"case_study": "archived",
"estimator": "./P41594_Allosteric_RF_Model/P41594_Allosteric_RF_Model.json"
}
}
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Expand Up @@ -4145,7 +4145,7 @@
"alg": "sklearn.ensemble._forest.RandomForestRegressor",
"randomState": 2,
"pref_name": "mGLU 5 Orthosteric",
"case_study": "pd",
"case_study": "archived",
"estimator": "./P41594_Orthosteric_RF_Model/P41594_Orthosteric_RF_Model.json"
}
}
2 changes: 1 addition & 1 deletion models/Q13224_RF_Model/Q13224_RF_Model_meta.json
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Expand Up @@ -4145,7 +4145,7 @@
"alg": "sklearn.ensemble._forest.RandomForestRegressor",
"randomState": 2,
"pref_name": "NMDA",
"case_study": "pd",
"case_study": "archived",
"estimator": "./Q13224_RF_Model/Q13224_RF_Model.json"
}
}
Original file line number Diff line number Diff line change
Expand Up @@ -4145,7 +4145,7 @@
"alg": "sklearn.ensemble._forest.RandomForestRegressor",
"randomState": 2,
"pref_name": "mGLU 1 Allosteric",
"case_study": "pd",
"case_study": "archived",
"estimator": "./Q13255_Allosteric_RF_Model/Q13255_Allosteric_RF_Model.json"
}
}
22 changes: 21 additions & 1 deletion templates/index.html
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Expand Up @@ -107,6 +107,7 @@ <h1>QSPRpred - pChEMBL Value Prediction</h1>
<li class="active"><a data-toggle="tab" href="#thyroid">Thyroid</a></li>
<li><a data-toggle="tab" href="#pd">Parkinson's Disease</a></li>
<li><a data-toggle="tab" href="#nephrotox">Nephrotoxicity</a></li>
<li><a data-toggle="tab" href="#archived">Archived</a></li>
</ul>

<div class="tab-content">
Expand Down Expand Up @@ -151,7 +152,26 @@ <h1>QSPRpred - pChEMBL Value Prediction</h1>
</div>
<div id="nephrotox" class="tab-pane fade">
<p>MIE models for the nephrotoxicity case study are in progress.</p>
</div>
</div>
<div id="archived" class="tab-pane fade">
<label>MIE models:</label><br>
<div style="display: grid; grid-template-columns: repeat(auto-fill, minmax(250px, 1fr)); gap: 10px;">
{% for model in models if model.case_study == 'archived' %}
<div class="model-tile {% if model.name in model_names %}checked{% endif %}">
<input type="checkbox" id="model_pd_{{ loop.index }}" name="model" value="{{ model.name }}" {% if model.name in model_names %}checked{% endif %}>
<label for="model_pd_{{ loop.index }}">
<strong>{{ model.pref_name }}</strong><br>
Model: {{ model.name }}<br>
Property: {{ model.target_property_name }}<br>
Task: {{ model.target_property_task }}<br>
Calculator: {{ model.feature_calculator }}<br>
Algorithm: {{ model.algorithm }}<br>
<a href="{{ url_for('download_qmrf', path=model.currDir, target=model.name) }}">Download QMRF here</a>
</label>
</div>
{% endfor %}
</div>
</div>


<br>
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