Arun Yethiraj
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Chemistry
Arun Yethiraj's Degrees
- PhD Chemical Engineering University of California, Berkeley
- Masters Chemistry Stanford University
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(Suggest an Edit or Addition)Arun Yethiraj's Published Works
Published Works
- Polarized neutron determination of the magnetic excitations in YBa2Cu3O7. (1993) (266)
- A new coarse-grained model for water: the importance of electrostatic interactions. (2010) (158)
- Self-diffusion and viscosity in electrolyte solutions. (2012) (133)
- Monte Carlo density functional theory of nonuniform polymer melts (1995) (124)
- Monte-Carlo simulation of polymers confined between flat plates (1990) (113)
- Why are lipid rafts not observed in vivo? (2007) (112)
- Rheology of Confined Polymer Melts (1996) (100)
- Influence of charge and magnetic ordering on the insulator-metal transition in Pr1-xCaxMnO3. (1995) (98)
- Effect of macromolecular crowding on reaction rates: a computational and theoretical study. (2009) (97)
- Polymer reference interaction site model theory: New molecular closures for phase separating fluids and alloys (1993) (91)
- Large‐Area Electric‐Field‐Induced Colloidal Single Crystals for Photonic Applications (2004) (91)
- Molecular simulation and continuum mechanics study of simple fluids in non-isothermal planar couette flows (1997) (88)
- Low-symmetry sphere packings of simple surfactant micelles induced by ionic sphericity (2017) (88)
- Short chains at surfaces and interfaces: A quantitative comparison between density-functional theories and Monte Carlo simulations (2003) (87)
- Solvent effects on the collapse dynamics of polymers (2001) (86)
- Phase behavior of semiflexible tangent hard sphere chains (1996) (82)
- Monte Carlo simulations and integral equation theory for microscopic correlations in polymeric fluids (1992) (81)
- Entropy-based mechanism of ribosome-nucleoid segregation in E. coli cells. (2011) (80)
- Density functional theory of polymers: A Curtin-Ashcroft type weighted density approximation (1998) (78)
- Molecular dynamics simulations of heat and momentum transfer at a solid–fluid interface: Relationship between thermal and velocity slip (2006) (77)
- Site–site correlations in short chain fluids (1990) (76)
- A finite element framework for studying the mechanical response of macromolecules: application to the gating of the mechanosensitive channel MscL. (2006) (76)
- Monte Carlo simulation of hard chain–hard sphere mixtures in slitlike pores (1989) (75)
- Generalized Flory equations of state for square‐well chains (1991) (75)
- Density functional theory for inhomogeneous polymer solutions (1994) (74)
- A New Coarse-Grained Force Field for Membrane-Peptide Simulations. (2011) (72)
- Rheological, thermodynamic, and structural studies of linear and branched alkanes under shear (1997) (70)
- Integral equation theory for the adsorption of chain fluids in slitlike pores (1991) (67)
- Magnetic Dynamics in Underdoped YBa2Cu3O7-x: Direct Observation of a Superconducting Gap. (1996) (65)
- Liquid‐state theory of the density dependent conformation of nonpolar linear polymers (1994) (64)
- Density Functional Theory for the Distribution of Small Ions around Polyions (1999) (64)
- Monte Carlo simulation of confined semiflexible polymer melts (1994) (63)
- Square‐well chains: Bulk equation of state using perturbation theory and Monte Carlo simulations of the bulk pressure and of the density profiles near walls (1991) (61)
- Square-well diatomics: Bulk equation of state, density profiles near walls, virial coefficients and coexistence properties (1991) (60)
- Implicit and explicit solvent models for the simulation of dilute polymer solutions (2006) (57)
- Why do arginine and lysine organize lipids differently? Insights from coarse-grained and atomistic simulations. (2013) (55)
- Dynamics in crowded environments: is non-Gaussian Brownian diffusion normal? (2014) (55)
- Interaction between colloids in solutions containing dissolved polymer (1992) (54)
- First-Principles United Atom Force Field for the Ionic Liquid BMIM(+)BF4(-): An Alternative to Charge Scaling. (2016) (54)
- Liquid state theory of polyelectrolyte solutions. (2009) (53)
- Entropic and enthalpic surface segregation from blends of branched and linear polymers. (1995) (53)
- A Monte Carlo simulation study of branched polymers. (2006) (53)
- Ab Initio Force Fields for Imidazolium-Based Ionic Liquids. (2016) (51)
- Integral equation theory of polymer blends: Numerical investigation of molecular closure approximations (1993) (51)
- Self‐consistent polymer integral equation theory: Comparisons with Monte Carlo simulations and alternative closure approximations (1992) (51)
- Integral Equation Theory for the Conformational Properties and Static Structure Factor of Polyelectrolyte Solutions (1997) (51)
- Surface segregation in polymer blends due to stiffness disparity (1994) (51)
- First-Principles, Physically Motivated Force Field for the Ionic Liquid [BMIM][BF4]. (2014) (50)
- Strongly charged flexible polyelectrolytes in poor solvents: Molecular dynamics simulations with explicit solvent (2003) (50)
- Integral equation theory of solutions of rigid polyelectrolytes (1997) (49)
- Small-angle neutron scattering study of flux line lattices in twinned YBa2Cu3O7. (1993) (48)
- Atomistic Simulations of Poly(ethylene oxide) in Water and an Ionic Liquid at Room Temperature (2014) (48)
- Computer Simulation Study of Two-Dimensional Polymer Solutions (2003) (48)
- Dilute Solutions of Strongly Charged Flexible Polyelectrolytes in Poor Solvents: Molecular Dynamics Simulations with Explicit Solvent (2006) (48)
- Theory for chain conformations and static structure of dilute and semidilute polyelectrolyte solutions (1998) (47)
- Polymer Melts at Solid Surfaces (2002) (47)
- Different states of synaptotagmin regulate evoked versus spontaneous release (2016) (46)
- Density functional theory for nonuniform polymers: Accurate treatment of the effect of attractive interactions (2003) (46)
- Perturbation density functional theory and Monte Carlo simulations for the structure of hard triatomic fluids in slitlike pores (1995) (44)
- Brownian dynamics simulations of salt-free polyelectrolyte solutions (2002) (44)
- Polymer‐induced forces between colloidal particles. A Monte Carlo simulation (1994) (43)
- Gating mechanisms of mechanosensitive channels of large conductance, I: a continuum mechanics-based hierarchical framework. (2008) (43)
- Structure of Polyelectrolyte Solutions. (1996) (42)
- Fracking: What Can Physical Chemistry Offer? (2013) (42)
- Monte Carlo simulation of the equilibrium partitioning of chain fluids between a bulk and a pore (1991) (41)
- Anionic Phospholipids Stabilize RecA Filament Bundles in Escherichia coli. (2015) (41)
- On the scaling of the critical temperature with the degree of polymerization in symmetric polymer blends (1992) (41)
- Lateral diffusion and percolation in membranes. (2006) (41)
- Crowding effects on association reactions at membranes. (2010) (41)
- Influence of Electronic Polarization on the Structure of Ionic Liquids. (2018) (40)
- The effect of salt on the melting of ice: A molecular dynamics simulation study. (2008) (40)
- Microscopic equations of state of polyethylene: Hard-chain contribution to the pressure (1993) (40)
- Local density enhancement in dilute supercritical solutions (2000) (40)
- Generalized van der Waals density functional theory for nonuniform polymers (2000) (39)
- Lateral diffusion of proteins in the plasma membrane: spatial tessellation and percolation theory. (2008) (39)
- Monte Carlo calculation of the osmotic second virial coefficient of off-lattice athermal polymers (1992) (39)
- Self-assembly of gemini surfactants: a computer simulation study. (2013) (37)
- Characterization of nanofibers formed by self-assembly of beta-peptide oligomers using small angle x-ray scattering. (2008) (35)
- Density functional theory for the nonspecific binding of salt to polyelectrolytes: thermodynamic properties. (2000) (35)
- Crowding effects on protein association: effect of interactions between crowding agents. (2011) (34)
- Local structure of fluids containing chain-like molecules: Polymer reference interaction site model with a Yukawa closure (1990) (34)
- Sequence-dependent interaction of β-peptides with membranes. (2010) (34)
- Water Dynamics in Gyroid Phases of Self-Assembled Gemini Surfactants. (2016) (34)
- Dynamics of chain molecules in disordered materials. (2006) (33)
- The effect of matrix structure on the diffusion of fluids in porous media. (2008) (33)
- Entropic Mechanism for the Lower Critical Solution Temperature of Poly(ethylene oxide) in a Room Temperature Ionic Liquid. (2015) (33)
- Driving Force for the Association of Hydrophobic Peptides: The Importance of Electrostatic Interactions in Coarse-Grained Water Models (2011) (33)
- Ab Initio Force Fields for Organic Anions: Properties of [BMIM][TFSI], [BMIM][FSI], and [BMIM][OTf] Ionic Liquids. (2018) (32)
- Two experimental tests of the halperin-lubensky-Ma effect at the nematic-smectic- A phase transition (1999) (32)
- Computer simulations and integral equation theory for the structure of salt-free rigid rod polyelectrolyte solutions: Explicit incorporation of counterions (1999) (31)
- Driving Force for the Association of Amphiphilic Molecules (2011) (31)
- Solvent effects in polyelectrolyte adsorption: computer simulations with explicit and implicit solvent. (2010) (31)
- Understanding the Properties of Ionic Liquids: Electrostatics, Structure Factors, and Their Sum Rules. (2019) (31)
- Microfluidic based platform for characterization of protein interactions in hydrogel nanoenvironments. (2007) (31)
- Diffusion of hard sphere fluids in disordered media: a molecular dynamics simulation study. (2004) (30)
- Gating mechanisms of mechanosensitive channels of large conductance, II: systematic study of conformational transitions. (2008) (30)
- Structure of Polyelectrolyte Solutions at a Charged Surface (2004) (29)
- Anisotropic vortex lattice in YBa2Cu3O7. (1993) (29)
- A diffusive anomaly of water in aqueous sodium chloride solutions at low temperatures. (2008) (29)
- Osmotic Pressure of Salt-Free Polyelectrolyte Solutions: A Monte Carlo Simulation Study (2005) (28)
- Equations of state for star polymers (1991) (28)
- The effects of local stiffness disparity on the surface segregation from binary polymer blends (1995) (28)
- Monte Carlo simulations and self-consistent integral equation theory for polyelectrolyte solutions (1999) (28)
- Structure and dynamics of conjugated polymers in liquid crystalline solvents. (2007) (27)
- Retardation of ice crystallization by short peptides. (2009) (27)
- Coarse-grained models for aqueous polyethylene glycol solutions. (2014) (26)
- On equations of state for hard chain fluids (1993) (26)
- Establishing Effective Simulation Protocols for β- and α/β-Mixed Peptides. I. QM and QM/MM Models. (2007) (26)
- Phase behavior of the Widom–Rowlinson mixture (1996) (25)
- Forces between surfaces immersed in polyelectrolyte solutions (1999) (25)
- Liquid state theories for the structure of water (2003) (25)
- Behavior of starlike polymers between walls (1991) (25)
- ISOTROPIC TO NEMATIC TRANSITION IN SEMIFLEXIBLE POLYMER MELTS (1998) (25)
- FRET by FET and Dynamics of Polymer Folding (2001) (24)
- Nonexponentiality of time dependent survival probability and the fractional viscosity dependence of the rate in diffusion controlled reactions in a polymer chain (2001) (24)
- Brownian dynamics simulations of polyelectrolyte solutions with divalent counterions (2003) (24)
- Establishing effective simulation protocols for β‐ and α/β‐peptides. III. Molecular mechanical model for acyclic β‐amino acids (2010) (23)
- Mechanosensitive Channels: Insights from Continuum-Based Simulations (2008) (23)
- Conformational Properties of Sodium Polystyrenesulfonate in Water: Insights from a Coarse-Grained Model with Explicit Solvent. (2015) (23)
- Cavity hydration dynamics in cytochrome c oxidase and functional implications (2017) (23)
- Two- and three-body interactions among nanoparticles in a polymer melt. (2011) (22)
- Establishing effective simulation protocols for beta- and alpha/beta-peptides. II. Molecular mechanical (MM) model for a cyclic beta-residue. (2008) (22)
- Adsorption and Dynamics of a Single Polyelectrolyte Chain near a Planar Charged Surface: Molecular Dynamics Simulations with Explicit Solvent. (2006) (21)
- Monte Carlo simulations for the phase behavior of symmetric nonadditive hard sphere mixtures (2003) (21)
- Ionic Hydrogen Bonds and Lipid Packing Defects Determine the Binding Orientation and Insertion Depth of RecA on Multicomponent Lipid Bilayers. (2016) (21)
- Effect of chain stiffness on the conformational properties, pair correlations, and equation of state of polymer melts (1994) (21)
- Local structure of model polymeric fluids: Hard‐sphere chains and the three‐dimensional fluctuating bond model (1992) (21)
- Density functional theory for pair correlation functions in polymeric liquids (2001) (21)
- Microscopic Equations-of-State for Hydrocarbon Fluids: Effect of Attractions and Comparison with Polyethylene Experiments (1993) (20)
- Fluctuation phenomena in structurally symmetric polymer blends (1995) (20)
- Integral equation theory of random copolymer melts (2005) (20)
- Molecular simulation and continuum mechanics investigation of viscoelastic properties of fluids confined to molecularly thin films (2001) (20)
- Orthogonal orientations for solvation of polymer molecules in smectic solvents. (2006) (19)
- Combining Diffusion NMR and Small-Angle Neutron Scattering Enables Precise Measurements of Polymer Chain Compression in a Crowded Environment. (2017) (19)
- Generation and sensing of membrane curvature: Where materials science and biophysics meet (2013) (19)
- Free Energy Calculations for the Peripheral Binding of Proteins/Peptides to an Anionic Membrane. 1. Implicit Membrane Models. (2014) (19)
- Conformational and Dynamic Properties of Poly(ethylene oxide) in an Ionic Liquid: Development and Implementation of a First-Principles Force Field. (2016) (19)
- Effect of polydispersity on diffusion in random obstacle matrices. (2012) (19)
- Self-consistent integral equation theory for semiflexible chain polyelectrolyte solutions (2000) (19)
- The effect of attractions on the structure of fused sphere chains confined between surfaces (1999) (18)
- MONTE CARLO SIMULATIONS FOR THE EQUATION OF STATE OF ATHERMAL LINEAR ALKANES (1995) (18)
- Influence of Charge Scaling on the Solvation Properties of Ionic Liquid Solutions. (2019) (17)
- Local structure of tangent-hard-sphere diatomic fluids (1993) (17)
- Atomistic simulations of dilute polyelectrolyte solutions. (2012) (17)
- Structure of void space in polymer solutions. (2010) (17)
- Molecular dynamics simulations of a fluid near its critical point. (2004) (17)
- Self-consistent mode-coupling theory for the viscosity of rodlike polyelectrolyte solutions. (2004) (17)
- Phase behavior of semiflexible polymer chains. (2008) (17)
- Comment on "Isolating the non-polar contributions to the intermolecular potential for water-alkane interactions" [J. Chem. Phys. 141, 064905 (2014)]. (2016) (16)
- Proper Thermal Equilibration of Simulations with Drude Polarizable Models : Temperature Grouped Dual-Nos ́e-Hoover Thermostat. (2019) (16)
- ION BINDING IN TOBACCO MOSAIC VIRUS SOLUTIONS (1998) (16)
- A computational framework for mechanical response of macromolecules: application to the salt concentration dependence of DNA bendability. (2009) (16)
- Swelling of polymers in porous media. (2009) (15)
- Monte Carlo simulation and self-consistent integral equation theory for polymers in quenched random media. (2005) (15)
- Integral equation theory of random copolymer melts: self-consistent treatment of intramolecular and intermolecular correlations. (2005) (14)
- The Driving Force for the Complexation of Charged Polypeptides. (2019) (14)
- Excited state kinetics of neutral transition metal atoms by stimulated emission pumping: V*(3d44s,a4D)+hydrocarbons (1997) (14)
- Phonon anomalies and the magnetic transition in pure and Cr-doped V2O (1987) (14)
- Conformational properties of isolated polyelectrolytes in poor solvents (1999) (13)
- Single molecule spectroscopy of conjugated polymer chains in an electric field-aligned liquid crystal. (2008) (13)
- Effect of secondary structure on the self-assembly of amphiphilic molecules: a multiscale simulation study. (2012) (13)
- Temperature-induced orientational transitions in freely suspended nematic films. (1995) (13)
- Monte Carlo simulations and integral equation theory for the structure of telechelic polymers (2003) (13)
- Electrostatic Interactions Govern "Odd/Even" Effects in Water-Induced Gemini Surfactant Self-Assembly. (2017) (13)
- Molecular-dynamics simulations for nonclassical kinetics of diffusion-controlled bimolecular reactions. (2005) (12)
- Sequence dependent self-assembly of beta-peptides: Insights from a coarse-grained model. (2010) (12)
- Swing motion as a diffusion mechanism of lipid bilayers in a gel phase. (2016) (12)
- Self-Assembly of β-Peptides: Insight from the Pair and Many-Body Free Energy of Association (2010) (12)
- Molecular modeling of polymers at surfaces (1999) (12)
- Conformational and Dynamic Properties of Poly(ethylene oxide) in BMIM+BF4–: A Microsecond Computer Simulation Study Using ab Initio Force Fields (2018) (12)
- Integral equation theory for the surface segregation from blends of linear and star polymers (2000) (12)
- Grotthuss Transport of Iodide in EMIM/I3 Ionic Crystal. (2018) (12)
- Structure of room temperature ionic liquids (2016) (11)
- The Driving Force for the Association of Gemini Surfactants. (2017) (11)
- Structure and dynamics of short chain molecules in disordered porous materials: a molecular dynamics simulation study. (2007) (11)
- An Integral Equation Theory for the Widom–Rowlinson Mixture (2000) (11)
- Local structure and orientational correlations in fluids composed of linear triatomic molecules (1994) (10)
- Dynamics of Water in Gemini Surfactant-Based Lyotropic Liquid Crystals. (2016) (10)
- Entanglement effects in mode coupling theories of polymers (2002) (10)
- Integral equation theory for the structure of DNA solutions (2002) (10)
- Monte Carlo simulation of semiflexible hard triatomic fluids (1994) (9)
- Numerical Simulation of Nanoindentation and Patch Clamp Experiments on Mechanosensitive Channels of Large Conductance in Escherichia coli (2009) (9)
- Computer simulations of protein diffusion in compartmentalized cell membranes. (2009) (9)
- Conformational Properties of a Polymer in an Ionic Liquid: Computer Simulations and Integral Equation Theory of a Coarse-Grained Model. (2015) (9)
- The structure of amorphous polymers near surfaces: athermal systems (1998) (9)
- Sequence-directed organization of beta-peptides in self-assembled monolayers. (2009) (9)
- Integral equations for polymers in quenched random media (2002) (9)
- Structural and thermodynamic properties of a freely-jointed Yukawa hard-sphere chain fluid (2001) (8)
- Integral equation theory for two-dimensional polymer melts. (2005) (8)
- The effect of acid-base equilibria on the fractional charge and conformational properties of polyelectrolyte solutions (2001) (8)
- Density functional theory and Monte Carlo simulations for hard sphere fluids in square and rectangular channels (2002) (8)
- A Monte Carlo study of the self-assembly of bacteriorhodopsin. (2002) (8)
- Osmotic Pressure of Polyelectrolyte Solutions with Salt: Grand Canonical Monte Carlo Simulation Studies (2015) (7)
- Neutron-scattering study of the magnon energies and intensities in iron. (1991) (7)
- The effect of crowder charge in a model polymer-colloid system for macromolecular crowding: Polymer structure and dynamics. (2017) (7)
- The influence of the polymer chain stiffness on tracer diffusion in polymeric matrices (2011) (7)
- Integral equation theory for symmetric nonadditive hard sphere mixtures. (2005) (7)
- Dynamics of fluids near the consolute critical point: a molecular-dynamics study of the Widom-Rowlinson mixture. (2005) (7)
- Dynamics of probes in model glassy matrices. (2006) (7)
- Thermodynamics and local structure of vinyl polymer melts (1995) (7)
- Anisotropic diffusion of elongated and aligned polymer chains in a nematic solvent. (2006) (7)
- A simulation method for the phase diagram of complex fluid mixtures. (2018) (7)
- Liquid-Liquid Phase Separation As the Second Step of Complex Coacervation. (2020) (6)
- A Transferable Polarizable Force Field for Urea Crystals and Aqueous Solutions. (2020) (6)
- Deep Eutectic Solvents: Molecular Simulations with a First-Principles Polarizable Force Field. (2021) (6)
- Dynamics of two-dimensional and quasi-two-dimensional polymers. (2013) (6)
- The behavior of fluids near solutes: a density functional theory and computer simulation study. (2004) (6)
- Integral equation theory of randomly coupled multiblock copolymer melts: effect of block size on the phase behavior. (2005) (5)
- The behavior of salt-free polyelectrolyte solutions at charged surfaces (2003) (5)
- Why Lithium Ions Stick to Some Anions and Not Others. (2021) (5)
- Importance of hydrophobic traps for proton diffusion in lyotropic liquid crystals. (2016) (5)
- Dynamics of water confined in lyotropic liquid crystals: Molecular dynamics simulations of the dynamic structure factor. (2016) (5)
- Permeation of a hard sphere fluid into a quenched matrix. (2007) (5)
- Jagannathan and Yethiraj Reply (2005) (5)
- Correction to "Influence of Electronic Polarization on the Structure of Ionic Liquids". (2018) (4)
- Comment on "Vortex dynamics and melting in niobium" (1995) (3)
- Counterion-Regulated Dynamics of Water Confined in Lyotropic Liquid Crystalline Morphologies. (2018) (3)
- More than Virtual Reality: Important New Physical Insights in Simulations of Biomolecules and Synthetic Polymers. (2017) (3)
- Can Polymer Chains Cross Each Other and Still Be Entangled? (2019) (3)
- Sequence-dependent pKa shift induced by molecular self-assembly: insights from computer simulation. (2012) (3)
- Coupling between the Dynamics of Water and Surfactants in Lyotropic Liquid Crystals. (2017) (3)
- Ion-Specific Confined Water Dynamics in Convex Nanopores of Gemini Surfactant Lyotropic Liquid Crystals. (2018) (3)
- Phase Behavior of Poly(ethylene oxide) in Room Temperature Ionic Liquids: A Molecular Simulation and Deep Neural Network Study. (2020) (3)
- Non-universality of the dynamic exponent in two-dimensional random media (2019) (3)
- Nonlinear feedback control of a class of nonlinear systems (1987) (3)
- Equations of state for square well chain fluids using the generalized Flory approach (1993) (3)
- Nematic ordering of hard rods under strong confinement in a dense array of nanoposts. (2020) (2)
- Erratum: “Nonexponentiality of time dependent survival probability and the fractional viscosity dependence of the rate in diffusion controlled reactions in a polymer chain” [J. Chem. Phys. 114, 9170 (2001)] (2001) (2)
- Weighted Density Approximation for Polymer Melts (1996) (2)
- Osmotic pressure of isotropic solutions of rodlike polymers (2003) (2)
- Response to ''Comment on 'Molecular simulation and continuum mechanics study of simple fluids in nonisothermal planar Couette flows' '' ÜJ. Chem. Phys. 111, 10730 Ñ1999Öá (1999) (2)
- Proton Diffusion through Bilayer Pores. (2017) (2)
- The JPC Periodic Table. (2019) (1)
- Palit et al. Reply. (2019) (1)
- IDENTIFICATION AND FEEDBACK CONTROL OF NONLINEAR SYSTEMS (1988) (1)
- A Solvation Induced Ring Puckering Effect in Fluorinated Prolines and Its Inclusion in Classical Force-Fields. (2020) (1)
- Supplemental Material : Combining diffusion NMR and SANS enables precise measurements of polymer chain compression in a crowded environment (2017) (1)
- Phase behavior of continuous-space systems: A supervised machine learning approach. (2020) (1)
- The effect of explicit counterion binding on the transference number of polyelectrolyte solutions. (2022) (1)
- Effect of diffusion constant on the morphology of dendrite growth in lithium metal batteries. (2021) (1)
- A Simulation Method for the Phase Diagrams of Polymer Blends (2018) (0)
- Non-universality of the dynamic exponent in two-dimensional random media (2019) (0)
- Sequence-directed organization in self-assembled monolayers of beta-peptides on solid surfaces: A Monte Carlo simulation study (2009) (0)
- Dynamics of Forster Energy Migration Across Polymer Chains in Solution (2000) (0)
- Molecular Modeling of Confined Polymer Melts in Shear Flow (1996) (0)
- The JPC Periodic Table. (2019) (0)
- Computer Simulations of Semi-flexible Polymer Chains (2008) (0)
- 13pTA-6 Anomalous density dependence of the viscosity of rod-like polyelectrolyte solutions (2004) (0)
- Viscoelastic Properties and Slip Behavior of Confined Polymer Melts (1997) (0)
- Membrane Obstacles Enhance the Sensitivity and Selectivity of Surface Condensation (2022) (0)
- SYMPOSIUM DD Heat and Mass Transport at Nanoscale-From Fundamentals to Devices (2005) (0)
- Phase behavior of polymer/ionic liquids mixture: a molecular dynamics study (2019) (0)
- Self-Assembly of Gemini Surfactants (2013) (0)
- Aqueous Lyotropic Liquid Crystalline Frank-Kasper Mesophases (2017) (0)
- A solvation induced ring puckering effect in fluorinated prolines and its inclusion in classical force-fields (2020) (0)
- Static Structure and Chain Conformations in Polyelectrolyte Solutions (1999) (0)
- Percolation and diffusion in two dimensional random media (2006) (0)
- Solvent and salt effects on the adsorption of polymers to charged surfaces (2006) (0)
- Brownian Dynamics Simulations of Polyelectrolyte Solutions (2002) (0)
- Self-Diffusion and Viscosity in Electrolyte Solutions B (2012) (0)
- Establishing effective simulation protocols for beta- and alpha/beta-peptides. III. Molecular mechanical model for acyclic beta-amino acids (2010) (0)
- Integrated Quantum/Classical Modeling of Hydrogenic Materials (1999) (0)
- Sensitive and Selective Polymer Condensation at Membrane Surface Driven by Positive Co-operativity (2023) (0)
- Tuning Lyotropic Liquid Crystalline Phase Behavior of Gemini Surfactants by Linker Parity (2015) (0)
- The JPC Periodic Table. (2019) (0)
- Crowding effects on protein association (2011) (0)
- THEORY AND SIMULATIONS OF POLYMERS AT SURFACES (1999) (0)
- Dynamics of fluids in complex environments (2008) (0)
- Chemically realistic coarse-grained models for polyelectrolyte solutions. (2022) (0)
- Polymers in ionic liquids (2016) (0)
- Selective and sensitive surface condensation driven by coupled phase behaviors of membrane and biopolymers. (2023) (0)
- A Tribute to Carol K. Hall. (2021) (0)
- Publisher's Note: Molecular Dynamics Simulations of a Fluid near Its Critical Point [ Phys. Rev. Lett. 93, 015701 (2004)] (2004) (0)
- Integral Equation Theory for the Conformation of Polyelectrolytes (1996) (0)
- A simulation study of poly(ethylene glycol) in ionic liquids using a physically motivated ab initio force-field (2014) (0)
- Effect of Size Polydispersity on Diffusion Behaviors of Traces in Random Obstacle Matrices (2013) (0)
- Solvent effects on the dynamics of polyelectrolyte chains near a charged wall: Molecular dynamics simulations with explicit solvent (2005) (0)
- Polymer conformation and dynamics in crowded environments: A combined diffusion NMR and small-angle neutron scattering study (2017) (0)
- Conformational properties and phase behavior of polymers in ionic liquids (2020) (0)
- Molecular dynamics studies of slow relaxation phenomena in glassy polymeric systems. (2006) (0)
- Importance of feature construction in machine learning for phase transitions. (2022) (0)
- Three-body Interactions in Polymer Nanocomposites (2010) (0)
- Fast estimation of ion-pairing for screening electrolytes: A cluster can approximate a bulk liquid. (2021) (0)
- Phonon Transport and Scattering in Semiconductor Nanowires (2005) (0)
- Surfactant Exchange in Low-Symmetry Sphere Packings of Micelles (2018) (0)
- Discontinuous molecular dynamics study of the diffusion of fluids in dynamic random media (2005) (0)
- Polymers: Melts and Blends (2002) (0)
- Technical Report: Understanding Functional Lyotropic Liquid Crystal Network Phase Self-Assembly and the Properties of Nanoconfined Water (2017) (0)
- Strategic incorporation of fluorinated prolines can lead to faster folding and stable proteins (2020) (0)
- Coarse-grained models for biological simulations (2011) (0)
- A Molecular Dynamics-Decorated Finite Element Method (MDeFEM) Framework for Simulating the Gating of Mechanosensitive Channels (2007) (0)
- Structure and Dynamics of Hydrogen Bonds in the Deep Eutectic Solvent Choline Chloride/Urea: from Molecular Dynamics Simulation with Ab-Initio Polarizable Force Field (2019) (0)
- Multi scale computer simulations of the self-assembly of block copolymeric beta-peptides (2011) (0)
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