Author

Xuan Wu

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Open access Sep 2026

Screening Short Peptide Binders to IL-17A Using Classical Molecular Dynamics

Identifying short peptides that bind therapeutically relevant proteins is a practical step toward developing peptide-based inhibitors. Here we screened 64 tetrapeptides for binding to the IL-17A homodimer using classical all-atom molecular dynamics simulations (GROMACS 2022.2, FF19SB force field, TIP3P water, 200 ns pr...

Xuan Wu, Wei Fu · bioRxiv · 0 citations

Open access Aug 2026

In silico design of bivalent multi-epitope mRNA vaccine candidates against Mycoplasma pneumoniae and Chlamydia pneumoniae

Two bivalent multi-epitope mRNA vaccine candidates against M. pneumoniae and C. pneumoniae are designed using an immunoinformatics-based strategy and predicted to be antigenic, non-toxic, non-allergenic, and structurally acceptable.

Xuan Wu, Yi-Zhong Xu, Weiwei Zhao et al. · BMC Microbiology · 0 citations