There is a newer version of the record available.

Published October 2, 2024 | Version v0.3.5
Software Open

Haddock3 web application

  • 1. Netherlands eScience Center
  • 2. Utrecht University @ BonvinLab

Description

Web application to run haddock3 Docking software.

What's Changed

  • Make run_dir optional when uploading in the builder by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/112
  • Use latest workflow builder packages and catalogs by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/137
  • Do not add water or ion residues to residue select component by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/145
  • Use table components from haddock3-ui by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/149
  • For protein docking scenario remove all non coord lines. by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/147
  • Allow easy expertise level to run protein ligand scenario by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/150
  • Run portal mode with docker compose by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/144
  • Ensembl loadable by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/151
  • Update catalog + use debug = false instead of less_io = true by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/153
  • Scoring scenario + refinement scenario + alascan page by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/140
  • Use haddock3 install which comes with cns executable by @sverhoeven in https://github.com/i-VRESSE/haddock3-webapp/pull/154

Full Changelog: https://github.com/i-VRESSE/haddock3-webapp/compare/v0.3.4...v0.3.5

Notes

If you use this software, please cite it using the metadata from this file.

Files

i-VRESSE/haddock3-webapp-v0.3.5.zip

Files (860.3 kB)

Name Size Download all
md5:c91955768cfeefbafe0fe8f40bc7dfa8
860.3 kB Preview Download

Additional details

Related works