Author

Xing-Fei Wei

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Open access Sep 2026

Structural and dynamical consistency in lipid vesicles across all-atom, MARTINI, and dissipative particle dynamics

We develop and validate a mesoscale dissipative particle dynamics (DPD)-4 lipid model, parameterized from an established MARTINI force field. We benchmark this DPD model and a MARTINI model for coarse-grained (CG) lipid vesicles against All-Atom simulations to evaluate their ability to capture structural properties acr...

Wan-Di Xu, Xing-Fei Wei, Ge-Ne Chong et al. · RSC Advances · 0 citations

Aug 2026

MCCX: Combining Monte Carlo, Convolutional Neural Networks and Boosting in Predicting Nanoparticle Viability

Modeling and prediction relying on learning from small experimental data sets is challenging, especially when the data set is insufficient, noisy or involves highly complex relationships. Leveraging Neural Networks (NNs), we developed predictive models capable of addressing such small data sets. We introduce MCCXcom...

Qiankun Mo, Xing-Fei Wei, Ravithree D. Senanayake et al. · ACS Applied Engineering Mate... · 0 citations