This review discusses the lattice Boltzmann–particle dynamics (LBPD) multiscale paradigm for the simulation of complex states of flowing matter at the interface between physics, chemistry, and biology. In particular, current large-scale LBPD simulations of biopolymer translocation across cellular membranes, molecular transport in ion channels, and amyloid aggregation in cells are described. Prospects are provided for future LBPD explorations in the direction of cellular organization, the direct simulation of full biological organelles, all the way up to physiological scales of potential relevance to future precision-medicine applications, such as the accurate description of homeostatic processes. It is argued that, with the advent of Exascale computing, the mesoscale physics approach advocated in this review may come to age in the next decade and open up new exciting perspectives for physics-based computational medicine.

中文翻译：

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物理-化学-生物学界面的介观模拟

这篇评论讨论了格子Boltzmann-粒子动力学（LBPD）多尺度范式，用于在物理，化学和生物学之间的界面上模拟流动物质的复杂状态。特别地，描述了生物聚合物跨细胞膜移位，离子通道中的分子运输和细胞中淀粉样蛋白聚集的当前大规模LBPD模拟。在细胞组织的方向，完整生物细胞器的直接模拟，一直到与将来的精密医学应用潜在相关的生理规模（例如稳态过程的准确描述）的方向上，为将来的LBPD探索提供了前景。有人认为，随着Exascale计算的出现，