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Analyzed 27 days ago. based on code collected 6 months ago.

Project Summary

cclib is an open source library, written in Python, for parsing and interpreting the results of computational chemistry packages.

The goals of cclib are:

* to facilitate the implementation of algorithms that are not specific to a particular computational chemistry package
* to provide a simple and standard interface to the results of computational chemistry calculations, particularly those results that are useful for algorithms or visualisation
* to maximise interoperability with other open source computational chemistry and cheminformatic software libraries

Tags

cheminformatics chemistry computational_chemistry library molecular_science python quantumchemistry research

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In a Nutshell, cclib...

This Project has No vulnerabilities Reported Against it

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Languages

Languages?height=75&width=75
Python
47%
HTML
22%
JavaScript
26%
5 Other
5%

30 Day Summary

Oct 6 2016 — Nov 5 2016

12 Month Summary

Nov 5 2015 — Nov 5 2016
  • 358 Commits
    Up + 16 (4%) from previous 12 months
  • 14 Contributors
    Up + 4 (40%) from previous 12 months

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