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Modeling and simulation of protein–surface interactions: achievements and challenges
Understanding protein–inorganic surface interactions is central to the rational design of new
tools in biomaterial sciences, nanobiotechnology and nanomedicine. Although a significant …
tools in biomaterial sciences, nanobiotechnology and nanomedicine. Although a significant …
The interaction of proteins with solid surfaces
JJ Gray - Current opinion in structural biology, 2004 - Elsevier
The interaction of proteins with solid surfaces is a fundamental phenomenon with
implications for nanotechnology, biomaterials and biotechnological processes. Kinetic and …
implications for nanotechnology, biomaterials and biotechnological processes. Kinetic and …
Molecular simulation studies of protein interactions with zwitterionic phosphorylcholine self-assembled monolayers in the presence of water
Y He, J Hower, S Chen, MT Bernards, Y Chang… - Langmuir, 2008 - ACS Publications
Molecular simulations were performed to study the interactions between a protein
(lysozyme, LYZ) and phosphorylcholine-terminated self-assembled monolayers (PC-SAMs) …
(lysozyme, LYZ) and phosphorylcholine-terminated self-assembled monolayers (PC-SAMs) …
Molecular simulation of protein adsorption and desorption on hydroxyapatite surfaces
Protein adsorption and desorption on material surfaces play a key role in the
biocompatibility of medical implants, biomineralization and protein separation. In this report …
biocompatibility of medical implants, biomineralization and protein separation. In this report …
Nanoparticle opsonization: Forces involved and protection by long chain polymers
The interactions between nanoparticles and opsonins have been studied thoroughly
through various models in order to elucidate the basic underlying forces of such interactions …
through various models in order to elucidate the basic underlying forces of such interactions …
[HTML][HTML] Understanding adsorption-desorption dynamics of BMP-2 on hydroxyapatite (001) surface
X Dong, Q Wang, T Wu, H Pan - Biophysical journal, 2007 - cell.com
The interaction between protein molecules and the hydroxyapatite (HAP) crystal is an
important research topic in many fields. However, the nature of their noncovalent bonding is …
important research topic in many fields. However, the nature of their noncovalent bonding is …
Kinetics of protein unfolding at interfaces
YF Yano - Journal of Physics: Condensed Matter, 2012 - iopscience.iop.org
The conformation of protein molecules is determined by a balance of various forces,
including van der Waals attraction, electrostatic interaction, hydrogen bonding, and …
including van der Waals attraction, electrostatic interaction, hydrogen bonding, and …
Biomolecular diffusional association
RR Gabdoulline, RC Wade - Current opinion in structural biology, 2002 - Elsevier
The primary method for the computational study of biomolecular diffusional association is
Brownian dynamics. Recent work has seen advances in the efficiency of computing …
Brownian dynamics. Recent work has seen advances in the efficiency of computing …
Characterization of two molluscan crystal‐modulating biomineralization proteins and identification of putative mineral binding domains
M Michenfelder, G Fu, C Lawrence… - Biopolymers …, 2003 - Wiley Online Library
Ethylenediamine‐tetraacetic acid extracted water‐soluble matrix proteins in molluscan
shells secreted from the mantle epithelia are believed to control crystal nucleation …
shells secreted from the mantle epithelia are believed to control crystal nucleation …
Lysozyme adsorption on polyethylene surfaces: why are long simulations needed?
The adsorption of lysozyme onto a polyethylene (PE) surface in an aqueous environment
was investigated via molecular dynamics (MD) simulation. The adsorption can be divided …
was investigated via molecular dynamics (MD) simulation. The adsorption can be divided …