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1. github.com › cclib › cclibGitHub - cclib/cclib: Parsers and algorithms for computational...

   github.com › cclib › 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 https://cclib.github.io.

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2. cclib.github.ioOverview — cclib 1.8.1 documentation

   cclib.github.io

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   cclib is an open source library, written in Python, for parsing and interpreting the results of computational chemistry packages. The goals of cclib are centered around the reuse of data obtained from these programs and contained in output files, specifically: extract (parse) data from the output files generated by multiple programs.

3. cclib.github.io › how_to_parseHow to parse and write — cclib 1.8.1 documentation - GitHub Pages

   cclib.github.io › how_to_parse

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   The cclib package provides four scripts to parse and write data: ccget, ccwrite, cda, and ccframe. ccget is used to parse attribute data from output files. ccwrite has the ability to list out all valid attribute data that can be parsed from an output format.

4. github.com › cclibcclib - GitHub

   github.com › cclib

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   Parsers and algorithms for computational chemistry logfiles (Julia bindings to the cclib Python package).

5. cclib.github.io › how_to_installHow to install — cclib 1.8.1 documentation - GitHub Pages

   cclib.github.io › how_to_install

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   This page describes how to download, install and use the basic functionality of cclib. Requirements. Before you install cclib, you need to make sure that you have the following: Python (at least version 3.7 is recommended) NumPy (at least version 1.15 is recommended)

6. docs.python.org › 3 › extending1. Extending Python with C or C++ — Python 3.13.0 documentation

   docs.python.org › 3 › extending

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   2 ημέρες πριν · 1. Extending Python with C or C++ ¶. It is quite easy to add new built-in modules to Python, if you know how to program in C. Such extension modules can do two things that can’t be done directly in Python: they can implement new built-in object types, and they can call C library functions and system calls.

7. stackoverflow.com › questions › 145270Calling C/C++ from Python? - Stack Overflow

   stackoverflow.com › questions › 145270

   4 Νοε 2014 · pybind11 is a lightweight header-only library that exposes C++ types in Python and vice versa, mainly to create Python bindings of existing C++ code.