Metadata-Version: 2.4
Name: funcnodes-chemprop
Version: 0.1.3
Author-email: Julian Kimmig <julian.kimmig@gmx.net>
License: AGPL-3.0
Requires-Python: <3.13,>=3.11
Description-Content-Type: text/markdown
License-File: LICENSE
Requires-Dist: funcnodes-pandas
Requires-Dist: chemprop
Requires-Dist: funcnodes
Requires-Dist: funcnodes-plotly
Dynamic: license-file

# 🧪 funcnodes-chemprop

funcnodes-chemprop is a funcnodes module that integrates the Chemprop deep learning framework for molecular property prediction into node-based pipelines. It allows you to load molecular data, featurize molecules, train a Chemprop model, and predict properties — all in an interactive, no-code/low-code environment powered by [FuncNodes](https://github.com/Linkdlab/funcnodes).

## 🧑‍💻 Developer Notes

We currently face issues if you use this module on Mac with enabled Metal Performance Shaders, we hope to be able to resolve this soon.
