turbomoleio
1.6.0

User guide

  • The data group files
  • The coord file
  • Running define
  • Outputs parsing
  • Appendix

Developer guide

  • Contributing
  • Output logs parsing
  • Define runner
  • Testing
  • Versioning
  • Backward-compatibility

Additional information

  • License
  • Changelog
  • Reporting bugs
turbomoleio
  • Python Module Index

Python Module Index

t
 
t
- turbomoleio
    turbomoleio.core
    turbomoleio.core.base
    turbomoleio.core.control
    turbomoleio.core.datagroups
    turbomoleio.core.molecule
    turbomoleio.core.periodic
    turbomoleio.core.symmetry
    turbomoleio.core.utils
    turbomoleio.input
    turbomoleio.input.define
    turbomoleio.input.templates
    turbomoleio.input.utils
    turbomoleio.output
    turbomoleio.output.data
    turbomoleio.output.files
    turbomoleio.output.parser
    turbomoleio.output.states
    turbomoleio.testing

© Copyright 2018-2024 BASF SE, Matgenix SRL.

Built with Sphinx using a theme provided by Read the Docs.