Erythrocytes (red blood cells, RBCs) are the most abundant circulating cells in the blood and
have been widely used in drug delivery systems (DDS) because of their features of …

Cancer is a significant cause of high mortality, while the adverse reactions caused by
traditional chemotherapy inevitably further increase the mortality rate. Although synthetic …

The MArtini Database (MAD-https://mad. ibcp. fr) is a web server designed for the sharing of
structures and topologies of molecules parametrized with the Martini coarse-grained (CG) …

Partial phagocytosis—called trogocytosis—of axons by microglia has been documented in
ex vivo preparations but has not been directly observed in vivo. The mechanisms that …

Visual Molecular Dynamics (VMD) is one of the most widely used molecular graphics
software in the community of theoretical simulations. So far, however, it still lacks a graphical …

Advances in coarse-grained molecular dynamics (CGMD) simulations have extended the
use of computational studies on biological macromolecules and their complexes, as well as …

The histamine H1 receptor (H1R) has recently been implicated in mediating cell proliferation
and cancer progression; therefore, high-affinity H1R-selective fluorescent ligands are …

Molecular dynamics (MD) simulations have become a highly important technique to
consider lipid membrane systems, and quite often they provide considerable added value to …

Atomistic molecular dynamics simulations of membrane proteins have been shown to be
extremely useful for characterizing the molecular features underlying their function, but …

Many biological phenomena involve the binding of proteins to a large object. Because the
electrostatic forces that guide binding act over large distances, truncating the size of the …