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AstraZeneca / chemicalx

A PyTorch and TorchDrug based deep learning library for drug pair scoring. (KDD 2022)
https://chemicalx.readthedocs.io
Apache License 2.0
708 stars 87 forks source link

Vectorize segments #75

Closed benedekrozemberczki closed 2 years ago

benedekrozemberczki commented 2 years ago

*Vectorizes the outer segmentation generation.

cthoyt commented 2 years ago

This PR doesn't make sense, it copies #74. Perhaps you should change the target onto @sebastiandro's branch https://github.com/sebastiandro/chemicalx/tree/mhcaddi-model