nitish6174 / cclib

Parsers and algorithms for computational chemistry logfiles

Home Page:cclib.github.io

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cclib

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cclib is a Python library that provides parsers for output files of computational chemistry packages. It also provides a platform for computational chemists to implement algorithms in a platform-independent way.

For more information, go to http://cclib.github.io. There is a mailing list for questions at cclib-users@lists.sourceforge.net.

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Parsers and algorithms for computational chemistry logfiles

cclib.github.io

License:BSD 3-Clause "New" or "Revised" License


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