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Analyzing CYP3A4 PDB structures

Nikhil Gupta
03 November 2026
tags: #openadmet

Analyzing CYP3A4 PDB structures

Many CYP3A4 entries have ligands poorly supported by density, and Nikhil lists which to exclude when training models.

By Nikhil Gupta. Read the full post on the OpenADMET blog.

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