AstraZeneca / chemicalx

A PyTorch and TorchDrug based deep learning library for drug pair scoring. (KDD 2022)
https://chemicalx.readthedocs.io
Apache License 2.0
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Add the TWOSIDES dataset with molecular features #37

Closed benedekrozemberczki closed 2 years ago

benedekrozemberczki commented 2 years ago
cthoyt commented 2 years ago

see https://github.com/kexinhuang12345/data_process/blob/c1ee3e036c9502501b7e8c4a590de8533985e328/data_process/DDI_utils.py