Chemical and geometric representation fidelity improves drug--target affinity prediction

arXiv:2609.13230 · q-bio.BM, cs.AI, cs.LG, stat.ML · Submitted 2026-09-02 · Read on arXiv

q-bio.BM, cs.AI, cs.LG, stat.ML

Submitted: 2026-09-02

Updated: 2026-09-02

Comments: 21 pages, 10 figures

License: http://arxiv.org/licenses/nonexclusive-distrib/1.0/

Terminology

• Fidelity — 2× in this paper · explained in 2 episodes
• Benchmark — 1× in this paper · explained in 2 episodes

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