Water-mediated ion pairing: Occurrence and relevance

NFA Van Der Vegt, K Haldrup, S Roke, J Zheng… - Chemical …, 2016 - ACS Publications
We present an overview of the studies of ion pairing in aqueous media of the past decade. In
these studies, interactions between ions, and between ions and water, are investigated with …

Classical electrostatics for biomolecular simulations

GA Cisneros, M Karttunen, P Ren, C Sagui - Chemical reviews, 2014 - ACS Publications
Classical atomistic simulations, also known as molecular mechanics simulations, use simple
potential-energy functions to model molecular systems at the atomic level. In this …

Bioinspired Graphene Nanopores with Voltage-Tunable Ion Selectivity for Na+ and K+

Z He, J Zhou, X Lu, B Corry - ACS nano, 2013 - ACS Publications
Biological protein channels have many remarkable properties such as gating, high
permeability, and selectivity, which have motivated researchers to mimic their functions for …

Atomistic simulations of membrane ion channel conduction, gating, and modulation

E Flood, C Boiteux, B Lev, I Vorobyov… - Chemical …, 2019 - ACS Publications
Membrane ion channels are the fundamental electrical components in the nervous system.
Recent developments in X-ray crystallography and cryo-EM microscopy have revealed what …

Salinity-dependent contact angle alteration in oil/brine/silicate systems: the critical role of divalent cations

MEJ Haagh, I Sîretanu, MHG Duits, F Mugele - Langmuir, 2017 - ACS Publications
The effectiveness of water flooding oil recovery depends to an important extent on the
competitive wetting of oil and water on the solid rock matrix. Here, we use macroscopic …

Positively charged membranes with fine-tuned nanopores for ultrafast and high-precision cation separation

MG Shin, JY Seo, H Park, YI Park, S Ji… - Journal of Materials …, 2021 - pubs.rsc.org
There is significant interest in high-performance positively charged membranes that enable
the fast and high-precision separation of various cationic substances for purifying water and …

Uranium Speciation and Mobilization in Thawing Permafrost

EK Skierszkan, VA Schoepfer, M Fellwock… - Environmental …, 2024 - ACS Publications
Uranium is a toxic and pervasive geogenic contaminant often associated with organic
matter. Its abundance and speciation in organic-rich permafrost soils are unknown, thereby …

A selectivity filter at the intracellular end of the acid-sensing ion channel pore

T Lynagh, E Flood, C Boiteux, M Wulf, VV Komnatnyy… - Elife, 2017 - elifesciences.org
Increased extracellular proton concentrations during neurotransmission are converted to
excitatory sodium influx by acid-sensing ion channels (ASICs). 10-fold sodium/potassium …

Microfluidic investigations of crude oil-brine interface elasticity modifications via brine chemistry to enhance oil recovery

Y Liu, J Kaszuba, J Oakey - Fuel, 2019 - Elsevier
Waterflooding has been widely adopted as an improved oil recovery technique since water
is, in general, inexpensive and readily available. More recently, low salinity waterflooding …

Ion-specific effects in carboxylate binding sites

MJ Stevens, SLB Rempe - The Journal of Physical Chemistry B, 2016 - ACS Publications
Specific ion binding by carboxylates (− COO–) is a broadly important topic because− COO–
is one of the most common functional groups coordinated to metal ions in metalloproteins …