[HTML][HTML] Surface modification of two-dimensional layered double hydroxide nanoparticles with biopolymers for biomedical applications
Layered double hydroxides (LDHs) are appealing nanomaterials for (bio) medical
applications and their potential is threefold. One can gain advantage of the structure of LDH …
applications and their potential is threefold. One can gain advantage of the structure of LDH …
Advances in clayff molecular simulation of layered and nanoporous materials and their aqueous interfaces
RT Cygan, JA Greathouse… - The Journal of Physical …, 2021 - ACS Publications
As a general-purpose force field for molecular simulations of layered materials and their fluid
interfaces, Clayff continues to see broad usage in atomistic computational modeling for …
interfaces, Clayff continues to see broad usage in atomistic computational modeling for …
Role of mineral surfaces in prebiotic chemical evolution. In silico quantum mechanical studies
There is a consensus that the interaction of organic molecules with the surfaces of naturally-
occurring minerals might have played a crucial role in chemical evolution and …
occurring minerals might have played a crucial role in chemical evolution and …
Methane and carbon dioxide adsorption on Illite
The adsorption of CH4 and CO2 onto illitic clay was investigated at the temperatures 298,
313, 328, 358, and 423 K (25, 40, 55, 85, and 150° C) over a range of pressures up to 50 …
313, 328, 358, and 423 K (25, 40, 55, 85, and 150° C) over a range of pressures up to 50 …
Polyelectrolyte-modified layered double hydroxide nanocontainers as vehicles for combined inhibitors
J Carneiro, AF Caetano, A Kuznetsova, F Maia… - RSC Advances, 2015 - pubs.rsc.org
In this work, nanocontainers based on layered double hydroxide (LDH) loaded with two
different corrosion inhibitors, namely 2-mercaptobenzothiazole (MBT) and cerium (III) nitrate …
different corrosion inhibitors, namely 2-mercaptobenzothiazole (MBT) and cerium (III) nitrate …
Wetting effects and molecular adsorption at hydrated kaolinite clay mineral surfaces
T Underwood, V Erastova… - The Journal of Physical …, 2016 - ACS Publications
In this study, classical molecular dynamics simulations have been used to understand the
key interactions and surface structure of a set of organic molecules at the hydrated surfaces …
key interactions and surface structure of a set of organic molecules at the hydrated surfaces …
Adsorption of nucleotides onto ferromagnesian phyllosilicates: Significance for the origin of life
U Pedreira-Segade, C Feuillie, M Pelletier… - … et Cosmochimica Acta, 2016 - Elsevier
The concentration of prebiotic organic building blocks may have promoted the formation of
biopolymers in the environment of the early Earth. We therefore studied the adsorption of …
biopolymers in the environment of the early Earth. We therefore studied the adsorption of …
How do nucleotides adsorb onto clays?
U Pedreira-Segade, J Hao, A Razafitianamaharavo… - Life, 2018 - mdpi.com
Adsorption of prebiotic building blocks is proposed to have played a role in the emergence
of life on Earth. The experimental and theoretical study of this phenomenon should be …
of life on Earth. The experimental and theoretical study of this phenomenon should be …
Interaction of natural organic matter with layered minerals: recent developments in computational methods at the nanoscale
The role of mineral surfaces in the adsorption, transport, formation, and degradation of
natural organic matter (NOM) in the biosphere remains an active research area owing to the …
natural organic matter (NOM) in the biosphere remains an active research area owing to the …
Adsorption of pharmaceuticals onto smectite clay minerals: A combined experimental and theoretical study
The adsorption of two pharmaceuticals, carbamazepine and paracetamol, onto the
expandable clay mineral saponite has been studied through the combination of kinetic …
expandable clay mineral saponite has been studied through the combination of kinetic …