All Published Workflows

2 workflows that have been reviewed and published

jupyter-notebook-protein-ligand-docking-tutorial-p
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Jupyter Notebook Protein-ligand Docking tutorial (PDBe REST API) using Biobb.
public

public

Protein-ligand Docking tutorials using BioExcel Building Blocks (biobb) This tutorials aim to illustrate the process of pro...
JSON Active site prediction Protein-ligand docking biobb_structure_utils biobb_chemistry biobb_io biobb_vs AutoDock Vina Biopython Fpocket NGLview Open Babel biobb-chemistry biobb-io biobb-structure-utils biobb-vs ipywidgets pdbparser Protein interaction experiment
Free
26
cheminformatics-active-site-generation
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Cheminformatics - Active site generation
public

public

This workflow generates a file describing the active site of the protein for each of the fragment screening crystal structure...
Active site prediction rdock Galaxy WorkflowHub Cheminformatics
Free