Chemprop

Chemprop is a repository containing message-passing neural networks for molecular property prediction.

Features

Chemprop is free to use under the MIT License
Documentation available
PyTorch-based framework
For training and evaluating message-passing neural networks
For molecular property prediction
Command Line Tutorials

Project Samples

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License

MIT License

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Additional Project Details

Operating Systems

Linux, Mac, Windows

Programming Language

Python

Related Categories

Python Machine Learning Software

Registered

2024-08-15

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