When biomaterials are inserted in a biological environment, for instance in a body implant,
proteins do quickly adsorb on the exposed surface. Such process is of fundamental …

Atomistic computer simulations of protein adsorption on the heterogeneous surface of
biomaterials and nanomaterials are reviewed. First, we present a very brief introduction to …

The sequential adsorption of two proteins of the same or of an unlike nature on a
heterogeneous hydrophobic surface is investigated through atomistic molecular dynamics …

The atomistic modeling of protein adsorption on surfaces is hampered by the different time
scales of the simulation (s) and experiment (up to hours), and the accordingly different …

Using atomistic computer simulations, we study the adsorption of different globular protein
fragments with different secondary structures on the surface of a hydrophilic glassy polymer …

The general principles that have been deduced from experimental observations of protein
adsorption are covered in several major review articles [1–3]. Our focus here is more …

We present a methodology to quantify the essential interactions at the interface between
inorganic solid nanoparticles (NPs) and biological molecules. Our model is based on pre …

Although the denaturing of adsorbed proteins on biomaterials surfaces is believed to lead to
adverse tissue reactions to implanted materials, very little is currently known of the actual …

The adsorption of LTP at the decane− water interface was modeled using all-atom and
coarse-grained (CG) molecular dynamics simulations. The CG model (300 ns simulation …

Understanding protein–inorganic surface interactions is central to the rational design of new
tools in biomaterial sciences, nanobiotechnology and nanomedicine. Although a significant …