1 citations · 1 across the 1 of their papers we have counts for
3 papers
cs.LG2026
M3OS: A Monte Carlo Graph Search-Orchestrated Multi-Agent LLM System for Evidence-Traced Molecular Optimization
Junjie Wang, Yaowei Jin, Ruohui Tang +7
Small-molecule optimization integrates medicinal-chemistry reasoning and computational evidence through iterative, multi-objective decisions. When large language models (LLMs) reas…
cs.LG2025
MolPIF: A Parameter Interpolation Flow Model for Molecule Generation
Yaowei Jin, Junjie Wang, Yufan Tang +11
Motivation: Structure-based drug design (SBDD) has advanced with deep generative models, but bridging the gap between continuous atomic coordinates and discrete atom types remains…
physics.bio-ph2024★ 1 cited
P2DFlow: A Protein Ensemble Generative Model with SE(3) Flow Matching
Yaowei Jin, Qi Huang, Ziyang Song +3
Biological processes, functions, and properties are intricately linked to the ensemble of protein conformations, rather than being solely determined by a single stable conformation…