SF-Cluster: Frustration-Guided MSA Subsampling for Alternative Protein Conformation Recovery
SF-Cluster: 挫折引导的MSA子采样用于替代蛋白质构象恢复
AI总结 提出SF-Cluster方法,利用预测的局部能量挫折模式对MSA进行子采样,以恢复替代蛋白质构象,在48个基准案例中优于AF-Cluster,尤其在变构系统中提升15.5个百分点。
Comments Accepted at the AI4Science Workshop at ICML 2026 (Oral)