cclib: parsers and algorithms for computational chemistry

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cclib is a Python library that provides parsers for computational

chemistry log files. It also provides a platform to implement algorithms in a package-independent manner.

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Avatar for a.dumi from gravatar.com a.dumi Avatar for berquist from gravatar.com berquist Avatar for Karol.Langner from gravatar.com Karol.Langner Avatar for mscho527 from gravatar.com mscho527 Avatar for shivupa from gravatar.com shivupa

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Release history Release notifications | RSS feed

2.0a1 pre-release

1.8.1

1.8.1rc2 pre-release

1.8

1.7.2

1.7.1

1.7

1.6.4

1.6.3

1.6.2

1.6.1

1.6

1.5.3

1.5.2

1.5.1

1.5.post1

1.5

1.4.1

1.4

1.3.2

1.3.1

This version

1.3

1.2

1.2b pre-release

1.0.1

1.0.1b pre-release

1.0

1.0a pre-release

0.9

0.8

0.7

0.7b pre-release

0.6.1

0.6

0.6b pre-release

0.5

0.5b pre-release

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cclib-1.3.tar.gz (8.0 MB view hashes)

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