Galaxy tools for Computational Chemistry

The start of something exciting!! Computational chemistry tools in Galaxy.

• Source code 📚 🔧
  • If you'd like to contribute tools please do!
• Tools live on Galaxy 🚀⭐
  • In collaboration with Björn Grüning and the Galaxy computational chemistry team, these tools are available on Galaxy Europe under the Chemical Toolbox section.

Contributing

See Contributing Guidelines, these are the same guidelines as found at the IUC repo.

Wrapping tools for Galaxy

Wrapping tools for use in Galaxy is easy! If you want to start please see the Galaxy wiki

Favourite tool resources (Must reads!)

• Planemo
• Building Tools with Planemo
• Galaxy XML Schema

Acknowledgements

• BGruening's tools repo
• IUC repo
• DevTeam repo