CDPKit (short for Chemical Data Processing Toolkit) is an open-source cheminformatics toolkit written in C++.

CDPKit comprises a set of software tools and a programming library called the Chemical Data Processing Library (CDPL). The CDPL provides a high-quality and well-tested modular implementation of basic functionality typically required by any higher-level cheminformatics software application.

In addition to the CDPL C++ API, an equivalent Python-interfacing layer is provided that allows to harness all of CDPL’s functionality easily from Python code. This PyPI project hosts source and pre-built binary packages (wheels) for a comfortable installation of the CDPL Python bindings on Linux, macOS and Windows via the pip command.

For more information about CDPKit and the CDPL please visit https://cdpkit.org.

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Credits

Author: Thomas Seidel

License

LGPLv2

Requires

Python >=3.8

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cdpkit-1.3.0-cp314-cp314t-manylinux_2_28_x86_64.whl (76.6 MB view details)

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Release history Release notifications | RSS feed

This release

1.3.0 This release

18 files

1.2.3

14 files

1.2.2

14 files

1.2.1

14 files

1.2.0

14 files

Pre-release

1.2.0.dev3

9 files

Pre-release

1.2.0.dev2

1 file

Pre-release

1.2.0.dev1

10 files

1.1.1

10 files

1.1.0

9 files

1.0.2

6 files

1.0.1

8 files

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