Research Object Crate for Cheminformatics - Enumerate ligands for docking

Original URL: https://workflowhub.eu/workflows/12/ro_crate?version=1

This workflow is used form the preparation of protein and ligands for docking. More info can be found at https://covid19.galaxyproject.org/cheminformatics/

Author
Tim Dudgeon, Simon Bray, Gianmauro Cuccuru, Björn Grüning, Rachael Skyner, Jack Scantlebury, Susan Leung, Frank von Delft
License
MIT

Contents

Main Workflow: Cheminformatics - Enumerate ligands for docking
Size: 7160 bytes
Main Workflow Diagram: Cheminformatics-1-Ligand_enumeration.svg
Size: 3960 bytes
Main Workflow Description: Cheminformatics-1-Ligand_enumeration.cwl
Size: 1801 bytes