ACS nanoHydrophobic and Hydrophilic InteractionsProteinsMolecular Dynamics SimulationProtein Conformationalpha-Helical
AI-Guided Hydrophobic Core Design of Robust Six-Helix Bundle Proteins.
Yinying Meng, Guojin Tang, Ruishi Wang, Bin Zheng, Yuanhao Liu, Hantian Zhang, Peng Zheng
Published: 202510.1021/acsnano.5c13783
Abstract
α-Helical domains are widespread and versatile, yet typically fail under low mechanical load because backbone hydrogen bonds unzip sequentially, limiting their use in force-bearing nanomaterials and molecular devices. We present an AI-guided strategy…
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