Keyphrases
Molecular Dynamics Simulation
100%
Adsorption
49%
Polydiallyldimethylammonium Chloride
41%
Atomistic Simulation
38%
Lanthanides
38%
Ionic Liquid
37%
Aqueous Solution
35%
Amphiphiles
34%
Protein Surface
33%
Force Field
33%
Surfactant
29%
Self-assembly
29%
Polystyrene Sulfonate
28%
Atomistic Molecular Dynamics Simulations
28%
Anions
28%
Polyelectrolyte multilayers
25%
Mesoscopic
25%
Polymer Solution
25%
Oligoelectrolytes
25%
Salt Concentration
24%
Polystyrene
24%
Polyelectrolyte
23%
Sodium Salt
21%
Styrene Sulfonate
21%
Water Molecule
20%
Ionic Surfactant
20%
Hydrogen Bonds (H-bonds)
19%
Small-angle X-ray Scattering
19%
Solute
19%
Surface Charge
18%
Proteomimetics
18%
Brush Polymers
18%
Binding Peptide
18%
TETRA
18%
Organic Phase
18%
Polymer Solubility
17%
Solubility Parameter
17%
Anionic Complexes
17%
Random Copolymer
17%
Random Heteropolymers
17%
Polypropylene
17%
Atomistic Study
17%
Sulfone
17%
Heteropolymer
17%
Solid-liquid Interface
17%
Air-water Interface
17%
Water Permeability
17%
Peptide Surfactant
17%
Rare Earth Elements
17%
Electrostatic Interaction
16%
Surface Domains
16%
Contact Angle
15%
Water Structure
15%
Protein Function
15%
Metal-organic Frameworks (MOFs)
15%
Tb3+
15%
Silica Substrate
14%
Classical Force Field
14%
Phase Diagram
14%
Charge Regulation
14%
Liquid-liquid Interface
14%
Coordination Sphere
14%
Side Chain
14%
Positively Charged
14%
Hydrocarbons
14%
Ion Correlations
14%
Substrate Wettability
14%
Flory-Huggins Theory
14%
Ion Hydration
14%
Structure-property Relationships
13%
Head Group
13%
All-atom Molecular Dynamics Simulation
13%
Layer-by-layer Growth
12%
Charged Interface
12%
Four-layer
12%
Molecular Dynamics Study
12%
Ion-specific Effects
12%
Proteolytic Stability
12%
Charge Reversal
12%
Polarizable
12%
Electrolyte Solution
12%
Crystallization
11%
Crystalline Structure
11%
Polymer Fluids
11%
Electrolyte
11%
Chloride
11%
Tetrafluoroborate
11%
Ion Transport
11%
Homopolymer
11%
Receptor-binding Domain
11%
SARS-CoV-2 Spike Protein
11%
Thin Water Layer
11%
Free Energy
11%
Non-covalent
11%
Salt Ions
11%
Surface Charge Density
11%
Interfacial Water Structure
10%
Molecular Scale
10%
Brine
10%
All-atom
10%
Chemistry
Molecular Dynamics
67%
Ionic Liquid
49%
Lanthanoid Atom
39%
Hydrogen Bonding
34%
Molecular dynamics simulation
30%
formation
26%
Amphophile
21%
Solvation
20%
Multilayer
19%
Metal Ion
19%
Free Energy
19%
Dodecane
17%
Molecular Dynamics Study
17%
Poly(styrene)
17%
Coordination Sphere
17%
Sulfonate
17%
Heavy Metal
15%
Energetics
14%
Table Salt
14%
Permittivity
14%
Aqueous Solution
13%
Monolayers
13%
Dielectric Material
12%
Single Monomer Polymer
12%
Solvent Extraction
12%
Surfactant
11%
Sum-Frequency Generation
11%
Spectroscopy
11%
Dielectric Constant
10%
Octanol
10%
Liquid-Liquid Interface
10%
DNA
10%
Atomistic Simulation
9%
Nanomaterial
9%
Density Functional Theory
8%
Complexation
8%
Path Integral
8%
Coordination Chemistry
8%
Surface Property
8%
Neptunium
8%
Poly(propylene)
8%
Aliphatic Alcohol
8%
Acid-Base Equilibrium
8%
Liquid-Liquid Phase Separation
8%
Ion Association
8%
1,3-dimethylimidazolium
8%
Sulfone
8%
Electronic State
8%
Quantum Chemistry
8%
Halide
8%
Hydrogel
8%
Copolymer
8%
Nanofiber
8%
Dipole Interaction
8%
Hydration Enthalpy
8%
Adsorption Behavior
8%
Liquid Interface
8%
Effective Concentration
8%
Actinoid Atom
8%
Heavy Ion
8%
Intermolecular Force
8%
Amino Acid
8%
Nanoparticle
8%
dimer
8%
Ambient Reaction Temperature
8%
Polarizability
8%
electrode
8%
solution structure
8%
Non-Covalent Interactions
8%
Phase Diagrams
8%
Membrane Lipid
8%
Thermodynamic Method
8%
Lipid A
8%
Crystal Growth
8%
Gas Solubility
8%
Micro Porosity
8%
Water Purification
7%
Macromolecule
7%
X-Ray Scattering
7%
Small Angle X-Ray Scattering
7%
Face-Centered Cubic Crystal System
7%
BF 4
6%
stability
6%
Monte Carlo Method
5%
Møller-Plesset Perturbation Theory
5%
Cubic Crystal
5%
Body-Centered Cubic Crystal System
5%
Phase Change
5%
Carbon Dioxide
5%
Condensation
5%
Liquid Water
5%
Cytochrome P450
5%
X-Ray Diffraction
5%
Counterion
5%
Energy Barrier
5%
Corresponding State
5%
Hard-Sphere Model
5%