Add IRC tools API - Githubissues

TheoChem-VU / TCutility

Utility functions/classes for the TheoCheM programs

https://theochem-vu.github.io/TCutility/

MIT License

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Add IRC tools API #256

Closed YHordijk closed 3 months ago

YHordijk commented 5 months ago

We currently have a very nice command line interface tool for concatenating IRC paths. It would be nice to move it to a simple Python API in the tcutility.analysis module. The CLI can then use this new module.