Jae-Mun Choi

When Retrieval Beats Generation: A Three-Condition Framework for AI-Driven Molecular Linker Design, with PROTAC as a Case Study

This work takes PROTAC linker design as a representative case where data scarcity, multi-constraint satisfaction, and interpretability requirements simultaneously hold, and provides quantitative evidence of distributional mismatch between PROTAC linkers and general small-molecule linkers.