Contributing

Contributions are welcome, and they are greatly appreciated! Every little bit helps, and credit will always be given.

Documentation

CompChemUtils could always use more documentation, whether as part of the official CompChemUtils docs, in docstrings, or even on the web in blog posts, articles, and such.

Feedback

The best way to send feedback is to file an issue.

Bug Reports

When reporting a bug, please include:

  • Your operating system name and version.

  • Any details about your local setup that might be helpful in troubleshooting. (e.g., Python version)

  • Detailed steps to reproduce the bug.

Feature Requests

When proposing a feature, please include:

  • Explain in detail how it would work.

  • Keep the scope as narrow as possible, to make it easier to implement.

  • Remember that this is a volunteer-driven project, and that code contributions are welcome :)