3 papers
cs.LG2026
Spectral Rewiring for Exploration, Purification, and Model Merging
Zhilong Zhang, Hongli Yu, Huan-ang Gao +5
Reinforcement learning has become a standard post-training recipe for large language models, but dense full-parameter updates create two deployment-relevant bottlenecks: suppressed…
q-bio.BM2026
Demystifying Multimodal Biomolecular Co-design With Intrinsic Geodesic Coupling
Keyue Qiu, Xintong Wang, Zhilong Zhang +2
Biomolecules such as proteins and small-molecule ligands play a central role in biological systems, arising from the tight interplay between sequence and three-dimensional structur…
q-bio.BM2025
Empower Structure-Based Molecule Optimization with Gradient Guided Bayesian Flow Networks
Keyue Qiu, Yuxuan Song, Jie Yu +7
Structure-Based molecule optimization (SBMO) aims to optimize molecules with both continuous coordinates and discrete types against protein targets. A promising direction is to exe…