Python Macromolecular Coarse-Grained Flexibility tutorial
Version 3 (latest)

Version 3 (latest)

Version 2

Version 1 (earliest)

Workflow Type: Python

Stable

Macromolecular Coarse-Grained Flexibility (FlexServ) tutorial using BioExcel Building Blocks (biobb)

This tutorial aims to illustrate the process of generating protein conformational ensembles from 3D structures and analysing its molecular flexibility, step by step, using the BioExcel Building Blocks library (biobb).

Copyright & Licensing

This software has been developed in the MMB group at the BSC & IRB for the European BioExcel, funded by the European Commission (EU H2020 823830, EU H2020 675728).

Licensed under the Apache License 2.0, see the file LICENSE for details.

SEEK ID: https://workflowhub.eu/workflows/553?version=3

DOI: 10.48546/workflowhub.workflow.553.3

Version History

Version 3 (latest) Created 25th Mar 2026 at 12:47 by Genís Bayarri

Update to 5.2.*

Frozen Version-3 78ff01b

Version 2 Created 6th Aug 2025 at 12:32 by Genís Bayarri

Update to 5.1.*

Frozen Version-2 7a9e9eb

Version 1 (earliest) Created 2nd Aug 2023 at 12:23 by Genís Bayarri

Initial commit

Frozen Version-1 3298a13

Creators and Submitter

Creators

Submitter

Genís Bayarri

Discussion Channel

BioExcel Workflows

Citation

Hospital, A., & Bayarri, G. (2026). Python Macromolecular Coarse-Grained Flexibility tutorial. WorkflowHub. https://doi.org/10.48546/WORKFLOWHUB.WORKFLOW.553.3

License

Apache License 2.0 (Apache-2.0)

Activity

Views: 4081 Downloads: 1387

Created: 2nd Aug 2023 at 12:23

Last updated: 25th Mar 2026 at 12:47

Python Macromolecular Coarse-Grained Flexibility tutorial Version 3 (latest) Version 3 (latest) Version 2 Version 1 (earliest)