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scikit-fingerprints
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MoleculeNet_Lipophilicity

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Tabular Regression

Graph Machine Learning

Text Classification

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morgul10 commited on Jul 17, 2024

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 # MoleculeNet Lipophilicity
-Lipophilicity (Free Solvation Database) dataset, part of MoleculeNet [[1]](#1) benchmark. It is intended to be used through
 [scikit-fingerprints](https://github.com/scikit-fingerprints/scikit-fingerprints) library.
 The task is to predict octanol/water distribution coefficient (logD) at pH 7.4. Targets are already log transformed, and are a unitless ratio.

 # MoleculeNet Lipophilicity
+Lipophilicity dataset, part of MoleculeNet [[1]](#1) benchmark. It is intended to be used through
 [scikit-fingerprints](https://github.com/scikit-fingerprints/scikit-fingerprints) library.
 The task is to predict octanol/water distribution coefficient (logD) at pH 7.4. Targets are already log transformed, and are a unitless ratio.