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cuik_molmaker

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C++/python module for featurizing molecules

Installation

To install this package, run one of the following:

Conda
$conda install conda-forge::cuik_molmaker

Usage Tracking

0.2
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Downloads (Last 6 months): 0

Description

cuik-molmaker is a specialized package designed for molecular featurization, converting chemical structures into formats that can be effectively used as inputs for deep learning models, particularly graph neural networks (GNNs).

About

Summary

C++/python module for featurizing molecules

Last Updated

Dec 10, 2025 at 17:17

License

Apache-2.0

Supported Platforms

macOS-64
win-64
linux-64