This is the source code for a nanoHUB tool that demonstrates how to use Chemprop within Python (in a Jupyter notebook) using Chemprop v1.4.1.
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Demo of Chemprop for the nanoHUB Hands-on Data Science and Machine Learning Training Series
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kevingreenman/chemprop-demo
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Demo of Chemprop for the nanoHUB Hands-on Data Science and Machine Learning Training Series
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