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Recent progress in the science of complex coacervation
Complex coacervation is an associative, liquid–liquid phase separation that can occur in
solutions of oppositely-charged macromolecular species, such as proteins, polymers, and …
solutions of oppositely-charged macromolecular species, such as proteins, polymers, and …
Implicit solvation methods for catalysis at electrified interfaces
Implicit solvation is an effective, highly coarse-grained approach in atomic-scale simulations
to account for a surrounding liquid electrolyte on the level of a continuous polarizable …
to account for a surrounding liquid electrolyte on the level of a continuous polarizable …
The role of charge in microdroplet redox chemistry
In charged water microdroplets, which occur in nature or in the lab upon ultrasonication or in
electrospray processes, the thermodynamics for reactive chemistry can be dramatically …
electrospray processes, the thermodynamics for reactive chemistry can be dramatically …
Decoding Electrochemical Processes of Lithium‐Ion Batteries by Classical Molecular Dynamics Simulations
Lithium‐ion batteries (LIBs) have played an essential role in the energy storage industry and
dominated the power sources for consumer electronics and electric vehicles. Understanding …
dominated the power sources for consumer electronics and electric vehicles. Understanding …
50th Anniversary Perspective: A Perspective on Polyelectrolyte Solutions
From the beginning of life with the information-containing polymers until the present era of a
plethora of water-based materials in health care industry and biotechnology, polyelectrolytes …
plethora of water-based materials in health care industry and biotechnology, polyelectrolytes …
Ultrasensitive, stretchable, and fast-response temperature sensors based on hydrogel films for wearable applications
Conductive hydrogels can be used in wearable electronics integrated with skin, but the bulk
structure of existing hydrogel-based temperature sensors limits the wearing comfort …
structure of existing hydrogel-based temperature sensors limits the wearing comfort …
Comparative roles of charge, π, and hydrophobic interactions in sequence-dependent phase separation of intrinsically disordered proteins
Endeavoring toward a transferable, predictive coarse-grained explicit-chain model for
biomolecular condensates underlain by liquid–liquid phase separation (LLPS) of proteins …
biomolecular condensates underlain by liquid–liquid phase separation (LLPS) of proteins …
Water dielectric effects in planar confinement
We investigate the dielectric profile of water confined between two planar polar walls using
atomistic molecular dynamics simulations. For a water slab thickness below 1 nm the …
atomistic molecular dynamics simulations. For a water slab thickness below 1 nm the …
Ion transport in complex layered graphene-based membranes with tuneable interlayer spacing
Investigation of the transport properties of ions confined in nanoporous carbon is generally
difficult because of the stochastic nature and distribution of multiscale complex and imperfect …
difficult because of the stochastic nature and distribution of multiscale complex and imperfect …
Wettability of rock/CO2/brine systems: A critical review of influencing parameters and recent advances
Carbondioxide injection into geological formations is a promising method of optimizing
hydrocarbon recovery, as well as improving CO 2 geo-storage security. However, the …
hydrocarbon recovery, as well as improving CO 2 geo-storage security. However, the …