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Analyzed 21 minutes ago. based on code collected about 6 hours 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...

GNU General Public License v2.0 or later
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These details are provided for information only. No information here is legal advice and should not be used as such.

Project Security

Vulnerabilities per Version ( last 10 releases )

There are no reported vulnerabilities

Project Vulnerability Report

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Vulnerability Exposure Index

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About Project Security

Languages

Languages?height=75&width=75
HTML
45%
Python
36%
JavaScript
16%
6 Other
3%

30 Day Summary

May 7 2020 — Jun 6 2020

12 Month Summary

Jun 6 2019 — Jun 6 2020
  • 303 Commits
    Down -328 (51%) from previous 12 months
  • 20 Contributors
    Up + 6 (42%) from previous 12 months