Published on 26 September 2021

Chembl Filtered Dataset for TorchDrug

Zhang, Zuobai;Zhu, Zhaocheng

Description

A preprocessed ChEMBL dataset containing 456K molecules with 1310 kinds of diverse and extensive biochemical assays from paper "Strategies for Pre-training Graph Neural Networks" used by TorchDrug library.

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Metrics

Dataset Index

0.3

FAIR Score

13%

Citations

Mentions

Metrics Over Time

Publication Details

DOI

10.5281/zenodo.5528663

Publisher

Zenodo

Assigned Domain

Subfield

Radiology, Nuclear Medicine and Imaging

Field

Medicine

Domain

Health Sciences

Confidence Score

88%

Source

Open Alex

Normalization Factors

15.38

CTw

1.00

MTw

1.00