Shaoyong W. Lu
Shanghai Key Laboratory Of Flexible Medical Robotics
Shanghai, 200336, China
Shanghai, 200336, China
Last Updated: 09/26/2026
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Found 129 publications
Local Geometry Recovers but Cooperative Structure Does Not: Residue-Resolved Limits of All-Atom Reconstruction from Single-Bead Coarse-Grained Disordered Protein Ensembles.
Journal: Journal of chemical information and modeling
Published: May 27, 2026
Integrative computational simulations and functional assays decode allosteric dysregulation in a pathogenic SIRT6 variant.
Journal: International journal of biological macromolecules
Published: November 06, 2025
CENPI promotes the migration of liver cancer cells and the epithelial-mesenchymal transition process by activating the RAS/MEK/ERK signaling axis
Journal: Zhonghua gan zang bing za zhi = Zhonghua ganzangbing zazhi = Chinese journal of hepatology
Published: August 10, 2025
Molecular glues as GPCR modulators: unveiling three distinct mechanistic pathways for signal regulation.
Journal: Drug discovery today
Published: July 21, 2025
Identification of an Unexplored Dynamic Allosteric Site on the Activation Pathway of the Vasopressin V2 Receptor.
Journal: Journal of medicinal chemistry
Published: July 16, 2025
Mechanistic basis of N-terminal domain-mediated allostery in SIRT6: integrating molecular dynamics simulations and biochemical assays.
Journal: Molecular diversity
Published: July 03, 2025
Recent advances in computational strategies for allosteric site prediction: Machine learning, molecular dynamics, and network-based approaches.
Journal: Drug discovery today
Published: June 13, 2025
Diagnosis and differential diagnosis of small hepatocellular carcinoma in the context of cirrhosis
Journal: Zhonghua gan zang bing za zhi = Zhonghua ganzangbing zazhi = Chinese journal of hepatology
Published: May 26, 2025
Decoding the selective mechanism behind a monobody inhibitor to the phosphatase domain of SHP2: insights from molecular dynamics simulations.
Journal: Physical chemistry chemical physics : PCCP
Published: April 15, 2025
Exploring the distinct activation mechanisms of neuromedin B receptor through multiple replica molecular dynamics simulations and Markov state modeling.
Journal: Acta pharmacologica Sinica
Published: February 17, 2025
In silico identification and experimental validation of long-range allosteric inhibition of Staphylococcus aureus Cas9 catalytic activity by an anti-CRISPR protein AcrIIA14.
Journal: International journal of biological macromolecules
Published: February 13, 2025
Last Updated: 09/26/2026