Xiaojun Yao

37PUBLICATIONS
56CO-AUTHORS
Computational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Computational neuroscience (incl. mathematical neuroscience and theoretical neuroscience)Micro- and nanosystemsNanoelectromechanical systemsCheminformatics and quantitative structure-activity relationships
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Publications (37)

|Jul 10, 2026
TPS-Flow: Physics-Guided Flow-Based Generative Modeling of Protein Transition Paths.

|Jul 06, 2026
Discovery of a Potent NAMPT-Targeting PROTAC for the Suppression of Triple-Negative Breast Cancer via Macrophage Reprogramming.

|Jun 30, 2026
Bioorthogonal Catalytic Microneedles Based on a Cytotoxic PEI Matrix for Synergistic Melanoma Therapy.

|Jun 30, 2026
Engineering a Carbolong Nanoplatform for Piezoelectric Immunotherapy.

|May 26, 2026
A Multistage Virtual Screening Strategy Integrating Molecular Similarity, Deep Learning Scoring, and Molecular Docking toward the Discovery of Novel LRRK2 Inhibitors.

|May 22, 2026
Effect and Mechanism of Deep Eutectic Solvents as Mobile-Phase Additives on Retention Behavior of G-Quadruplexes in Reversed-Phase High-Performance Liquid Chromatography.

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Frequent Collaborators

10 joint publications

Huanxiang Liu

9 joint publications

Tingjun Hou

4 joint publications

Qianqian Zhang

4 joint publications

Linlin Zhuo