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Parsers and algorithms for computational chemistry logfiles

copied from cf-staging / cclib

Installers

Info: This package contains files in non-standard labels.
  • noarch v1.8.1

conda install

To install this package run one of the following:
conda install conda-forge::cclib
conda install conda-forge/label/cf201901::cclib
conda install conda-forge/label/cf202003::cclib

Description

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.


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