rdkit
RDKit is a collection of cheminformatics and machine-learning software written in C++ and Python.
Installation
To install this package, run one of the following:
Usage Tracking
Release_2017_09_3
Release_2017_09
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About
Summary
RDKit is a collection of cheminformatics and machine-learning software written in C++ and Python.
Last Updated
Jan 31, 2018 at 18:26
License
BSD 3-Clause
Total Downloads
5.6M
Supported Platforms
linux-64
macOS-64
Unsupported Platforms
win-64 Last supported version: Release_2017_09
macOS-arm64 Last supported version: 2025.09.4
linux-aarch64 Last supported version: 2025.09.4
linux-ppc64le Last supported version: 2025.09.4
win-32 Last supported version: Release_2017_09
Home
http://rdkit.orgGitHub Repository
https://github.com/rdkit/rdkitDocumentation
http://www.rdkit.org/docs/index.html