ShallowBench: Benchmarking Generative Drug Design Models on Shallow-Pocket Targets

arXiv:2606.06717Submitted Jun 8, 20260 benchmark results

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Abstract

5,780 shallow-pocket targets from CrossDocked2020; SOTA generative models show weaker predicted binding affinity on low-concavity interfaces (e.g., KRAS, MYC), highlighting a key failure mode.

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