2 papers
q-bio.BM2026
CryoNet.Refine: A One-step Diffusion Model for Rapid Refinement of Structural Models with Cryo-EM Density Map Restraints
Fuyao Huang, Xiaozhu Yu, Kui Xu +1
High-resolution structure determination by cryo-electron microscopy (cryo-EM) requires the accurate fitting of an atomic model into an experimental density map. Traditional refinem…
q-bio.QM2024
A Regressor-Guided Graph Diffusion Model for Predicting Enzyme Mutations to Enhance Turnover Number
Xiaozhu Yu, Kai Yi, Yu Guang Wang +1
Enzymes are biological catalysts that can accelerate chemical reactions compared to uncatalyzed reactions in aqueous environments. Their catalytic efficiency is quantified by the t…