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author | Navan Chauhan <navanchauhan@gmail.com> | 2020-08-29 19:25:45 +0530 |
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committer | Navan Chauhan <navanchauhan@gmail.com> | 2020-08-29 19:25:45 +0530 |
commit | 29798c7351ec3e3c6a13f40b4f80e804ec803006 (patch) | |
tree | 2b21a0159135a916ed0c40697478ce4315a70441 /app/templates/home.html | |
parent | acc43c48185e0f87f74b462bace85e3147578ff1 (diff) |
added single dock functionality, added more information
Diffstat (limited to 'app/templates/home.html')
-rw-r--r-- | app/templates/home.html | 25 |
1 files changed, 21 insertions, 4 deletions
diff --git a/app/templates/home.html b/app/templates/home.html index 541c313..43a84cc 100644 --- a/app/templates/home.html +++ b/app/templates/home.html @@ -2,12 +2,29 @@ {% block main %} <h2>Curie Web Demo</h2> - <p>Dock and Report performs molecular docking using AutoDock Vina, generates visualisations using PyMOL and then finds protein-ligand interactions using PLIP. It then compiles all of this into a PDF report and emails it to you.</p> + <p>Curie-Web is a part of The Curie Project which aims to make the process of Computer-Aided Drug Design as fast as possible.</p> + <p>The following are the currently active modules</p> + <h3>Docking</h3> <ul> - <li><a href="{{ url_for('dock_upload') }}">Dock and Report</a></li> - <li><a href="{{ url_for('status')}}">Job Status</a></li> - <li><a href="{{ url_for('generate') }}">Generate</a></li> + <li><a href="{{ url_for('dock_upload') }}">Dock and Report (Manual)</a> - You can enter your AutoDock Vina configuration, upload the PDBQT files and it will perform the molecular docking and generate a PDF with proper visualisations and protein-interaction profillings (Using PLIP) </li> + <li><a href="{{ url_for('dock_upload_single') }}">Dock and Report (Automatic)</a> - You just enter in the PDB Code, target compound's SMILES structure and name, it will automatically find a binding location and then perform docking and report generation</li> </ul> + <h3>Drug Designing</h3> + <ul> + <li><a href="{{ url_for('generate') }}">Generate</a> - You can use this to generate completely new compounds</li> + </ul> + + <h3>Researching</h3> + <ul> + <li><a href="{{ url_for('pubmed') }}">PubMed Search</a> - Handy PubMed search with direct download links</li> + <li>Qrious App - You can enter a question for a set of papers (e.g. ChemRxiv preprints) and it uses AI to answer it for each individual paper based on their abstract</li> + </ul> + + <h3>Misc.</h3> + <ul> + <li><a href="{{ url_for('status')}}">Job Status</a> - Check the job status </li> + <li><a href="{{ url_for('visualise')}}">Visualise</a> - Molecular Viewer </li> + </ul> <img src="{{url_for('static',filename='assets/workingInALaboratory.svg')}}" /> {% endblock %}
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