5 items tagged with 'Cheminformatics'.
Expertise: computer science, Cheminformatics
Tools: Python
Classification in Machine Learning
Associated Tutorial
This workflows is part of the tutorial Classification in Machine Learning, available in the GTN
Features
- Includes Galaxy Workflow Tests
- Includes a [Galaxy Workflow ...
Created: 25th Jun 2024 at 11:25, Last updated: 16th Sep 2024 at 14:07
High Throughput Molecular Dynamics and Analysis
Associated Tutorial
This workflows is part of the tutorial MD protein-ligand workflow (from PDB structure), available in the GTN
Thanks to...
Tutorial Author(s): Simon Bray, [Tharindu ...
Created: 25th Jun 2024 at 11:01, Last updated: 25th Jun 2024 at 11:02
Protein target prediction of a bioactive ligand with Align-it and ePharmaLib
Associated Tutorial
This workflows is part of the tutorial Zauberkugel, available in the GTN
Thanks to...
Tutorial Author(s): Aurélien F. A. Moumbock, [Simon ...
Created: 25th Jun 2024 at 10:55, Last updated: 25th Jun 2024 at 10:55
The workflow is part of COVID-19 analysis on usegalaxy.★
Virtual screening of the SARS-CoV-2 main protease (de.NBI-cloud, STFC)
Created: 8th Apr 2020 at 11:41