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Data splits for "Multimodal Out-of-Distribution Individual Uncertainty Quantification Enhances Binding Affinity Prediction for Polypharmacology"

Name: Data splits for "Multimodal Out-of-Distribution Individual Uncertainty Quantification Enhances Binding Affinity Prediction for Polypharmacology"
Creator: Zenodo
Published: 2025-10-21T17:14:48+08:00

Zenodo2025-10-21 更新2026-05-26 收录

数据链接：

https://zenodo.org/doi/10.5281/zenodo.17409086 数据链接链接失效反馈

官方服务：

资源简介：

Scaffold split and UMAP-based split for the ChEMBL 33 dataset.

应用场景：

提供机构：

Zenodo

创建时间：

2025-10-21

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Data splits for "Multimodal Out-of-Distribution Individual Uncertainty Quantification Enhances Binding Affinity Prediction for Polypharmacology"

资源简介：

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