Supported Applications


  • Description

    an interactive Python-based interface to the powerful Rosetta molecular modeling suite that enables users to design their own custom molecular modeling algorithms using Rosetta sampling methods and energy functions.

  • Usage Notes

    PyRosetta is a Python module. To start with a python interpreter configured with PyRosetta in SBGrid, use the 'python.pyrosetta' command.

  • Installation

    Use the following command to install this title with the CLI client: $ sbgrid-cli install pyrosetta Copy to clipboard
  • Primary Citation*

    S. Chaudhury, S. Lyskov, and J. Gray. 2010. PyRosetta: a script-based interface for implementing molecular modeling algorithms using Rosetta. Bioinformatics. 26(5): 689-691.

    • *Full citation information available through

  • Keywords

    Computational Chemistry

  • Default Versions

    Linux 64:  2022.12
    OS X INTEL:  2022.12

  • Other Versions

      Linux 64:

    • OS X INTEL:

  • Developers

    Jeffrey Gray, PyRosetta Team, Sergey Lyskov