| 1 | On the Possibility of Chiral Symmetry Breaking in Liquid Hydrogen Peroxide | 2.1 | 0 | Citations (PDF) |
| 2 | Computational investigation of water glasses using machine-learning potentials | 5.3 | 7 | Citations (PDF) |
| 3 | A first-principles machine-learning force field for heterogeneous ice nucleation on microcline feldspar | 2.7 | 34 | Citations (PDF) |
| 4 | Free-energy landscape and spinodals for the liquid–liquid transition of the TIP4P/2005 and TIP4P/Ice models of water | 2.2 | 18 | Citations (PDF) |
| 5 | Anneke Levelt Sengers: An international authority in the thermodynamics of fluids and a passionate advocate for women in science | 5.3 | 1 | Citations (PDF) |
| 6 | Formation of dissipative structures in microscopic models of mixtures with species interconversion | 5.3 | 15 | Citations (PDF) |
| 7 | Critical behavior in a chiral molecular model | 2.2 | 10 | Citations (PDF) |
| 8 | Melting curves of ice polymorphs in the vicinity of the liquid–liquid critical point | 2.2 | 6 | Citations (PDF) |
| 9 | Anomalies and Local Structure of Liquid Water from Boiling to the Supercooled Regime as Predicted by the Many-Body MB-pol Model | 3.1 | 55 | Citations (PDF) |
| 10 | Liquid–liquid criticality in the WAIL water model | 2.2 | 42 | Citations (PDF) |
| 11 | Homogeneous ice nucleation in an ab initio machine-learning model of water | 5.3 | 95 | Citations (PDF) |
| 12 | Fluid–fluid phase transitions in a chiral molecular model | 2.2 | 7 | Citations (PDF) |
| 13 | Crystal Prediction via Genetic Algorithms in a Model Chiral System | 2.1 | 1 | Citations (PDF) |
| 14 | Liquid-Liquid Transition in Water from First Principles | 5.8 | 73 | Citations (PDF) |
| 15 | Thermodynamics of DNA Hybridization from Atomistic Simulations | 2.1 | 30 | Citations (PDF) |
| 16 | Phase Equilibrium of Water with Hexagonal and Cubic Ice Using the SCAN Functional | 3.8 | 78 | Citations (PDF) |
| 17 | Effects of Trehalose on Lipid Membranes under Rapid Cooling using All-Atom and Coarse-Grained Molecular Simulations | 2.1 | 10 | Citations (PDF) |
| 18 | Manifestations of metastable criticality in the long-range structure of model water glasses | 11.0 | 29 | Citations (PDF) |
| 19 | Effect of configuration-dependent multi-body forces on interconversion kinetics of a chiral tetramer model | 2.2 | 11 | Citations (PDF) |
| 20 | Thermodynamics and kinetics of crystallization in deeply supercooled Stillinger–Weber silicon | 2.2 | 11 | Citations (PDF) |
| 21 | Interconversion-controlled liquid–liquid phase separation in a molecular chiral model | 2.2 | 14 | Citations (PDF) |
| 22 | A Computational Study of RNA Tetraloop Thermodynamics, Including Misfolded States | 2.1 | 29 | Citations (PDF) |
| 23 | Computational investigation of retro‐isomer equilibrium structures: Intrinsically disordered, foldable, and cyclic peptides | 1.8 | 7 | Citations (PDF) |
| 24 | Signatures of a liquid–liquid transition in an ab initio deep neural network model for water | 5.3 | 171 | Citations (PDF) |
| 25 | Genetic Algorithm Approach for the Optimization of Protein Antifreeze Activity Using Molecular Simulations | 3.8 | 18 | Citations (PDF) |
| 26 | Stability of Protein Structure during Nanocarrier Encapsulation: Insights on Solvent Effects from Simulations and Spectroscopic Analysis | 11.6 | 5 | Citations (PDF) |
| 27 | The Handedness of DNA Assembly around Carbon Nanotubes Is Determined by the Chirality of DNA | 2.1 | 10 | Citations (PDF) |
| 28 | Insights into Hydrophobic Ion Pairing from Molecular Simulation and Experiment | 11.6 | 43 | Citations (PDF) |
| 29 | Water’s two-critical-point scenario in the Ising paradigm | 2.2 | 26 | Citations (PDF) |
| 30 | A computational investigation of the thermodynamics of the Stillinger-Weber family of models at supercooled conditions | 1.1 | 9 | Citations (PDF) |
| 31 | Thermodynamic analysis of the stability of planar interfaces between coexisting phases and its application to supercooled water | 2.2 | 14 | Citations (PDF) |
| 32 | Nucleation in aqueous NaCl solutions shifts from 1-step to 2-step mechanism on crossing the spinodal | 2.2 | 92 | Citations (PDF) |
| 33 | Computational Investigation of the Effect of Pressure on Protein Stability | 3.1 | 15 | Citations (PDF) |
| 34 | Effect of heterochiral inversions on the structure of a β‐hairpin peptide | 1.9 | 11 | Citations (PDF) |
| 35 | Pattern of property extrema in supercooled and stretched water models and a new correlation for predicting the stability limit of the liquid state | 2.2 | 11 | Citations (PDF) |
| 36 | Low temperature protein refolding suggested by molecular simulation | 2.2 | 14 | Citations (PDF) |
| 37 | Forward flux sampling calculation of homogeneous nucleation rates from aqueous NaCl solutions | 2.2 | 61 | Citations (PDF) |
| 38 | A Computational Study of the Ionic Liquid-Induced Destabilization of the Miniprotein Trp-Cage | 2.1 | 10 | Citations (PDF) |
| 39 | Cavitation transition in the energy landscape: Distinct tensile yielding behavior in strongly and weakly attractive systems | 2.2 | 8 | Citations (PDF) |
| 40 | Water’s Thermal Pressure Drives the Temperature Dependence of Hydrophobic Hydration | 2.1 | 9 | Citations (PDF) |
| 41 | Combined molecular dynamics and neural network method for predicting protein antifreeze activity | 5.3 | 55 | Citations (PDF) |
| 42 | Communication: Nucleation rates of supersaturated aqueous NaCl using a polarizable force field | 2.2 | 23 | Citations (PDF) |
| 43 | Computational Investigation of the Effect of Backbone Chiral Inversions on Polypeptide Structure | 2.1 | 11 | Citations (PDF) |
| 44 | Advances in Computational Studies of the Liquid–Liquid Transition in Water and Water-Like Models | 43.1 | 190 | Citations (PDF) |
| 45 | Microscopic Origin of Hysteresis in Water Sorption on Protein Matrices | 3.1 | 3 | Citations (PDF) |
| 46 | Structural and dynamic properties of liquid tin from a new modified embedded-atom method force field | 2.5 | 33 | Citations (PDF) |
| 47 | Molecular modeling and structural characterization of a high glycine–tyrosine hair keratin associated protein | 2.1 | 22 | Citations (PDF) |
| 48 | Effect of material flexibility on the thermodynamics and kinetics of hydrophobically induced evaporation of water | 5.3 | 62 | Citations (PDF) |
| 49 | Computational investigation of surface freezing in a molecular model of water | 5.3 | 76 | Citations (PDF) |
| 50 | Two-structure thermodynamics for the TIP4P/2005 model of water covering supercooled and deeply stretched regions | 2.2 | 147 | Citations (PDF) |
| 51 | Thermodynamic Anomalies in Stretched Water | 3.1 | 32 | Citations (PDF) |
| 52 | Effects of disulfide bridges and backbone connectivity on water sorption by protein matrices | 2.7 | 6 | Citations (PDF) |
| 53 | Characterization of the liquid Li-solid Mo (1 1 0) interface from classical molecular dynamics for plasma-facing applications | 2.9 | 10 | Citations (PDF) |
| 54 | Perspective: Surface freezing in water: A nexus of experiments and simulations | 2.2 | 25 | Citations (PDF) |
| 55 | A free energy study of the liquid-liquid phase transition of the Jagla two-scale potential | 1.2 | 16 | Citations (PDF) |
| 56 | Communication: Relationship between local structure and the stability of water in hydrophobic confinement | 2.2 | 15 | Citations (PDF) |
| 57 | Water anomalous thermodynamics, attraction, repulsion, and hydrophobic hydration | 2.2 | 17 | Citations (PDF) |
| 58 | On the calculation of solubilities via direct coexistence simulations: Investigation of NaCl aqueous solutions and Lennard-Jones binary mixtures | 2.2 | 98 | Citations (PDF) |
| 59 | Molecular model for chirality phenomena | 2.2 | 25 | Citations (PDF) |
| 60 | Two-state thermodynamics and the possibility of a liquid-liquid phase transition in supercooled TIP4P/2005 water | 2.2 | 177 | Citations (PDF) |
| 61 | A cavitation transition in the energy landscape of simple cohesive liquids and glasses | 2.2 | 11 | Citations (PDF) |
| 62 | Computational investigation of cold denaturation in the Trp-cage miniprotein | 5.3 | 66 | Citations (PDF) |
| 63 | Computational investigation of dynamical transitions in Trp-cage miniprotein powders | 2.7 | 16 | Citations (PDF) |
| 64 | Density and bond-orientational relaxations in supercooled water | 1.1 | 15 | Citations (PDF) |
| 65 | Concentration Fluctuations and Capacitive Response in Dense Ionic Solutions | 3.1 | 72 | Citations (PDF) |
| 66 | Formation of cyclopentane methane binary clathrate hydrate in brine solutions | 3.9 | 72 | Citations (PDF) |
| 67 | Palmer et al. reply | 31.3 | 17 | Citations (PDF) |
| 68 | Computational investigation of structure, dynamics and nucleation kinetics of a family of modified Stillinger–Weber model fluids in bulk and free-standing thin films | 2.1 | 30 | Citations (PDF) |
| 69 | Thermodynamic and kinetic anisotropies in octane thin films | 2.2 | 22 | Citations (PDF) |
| 70 | Liquid li structure and dynamics: A comparison between OFDFT and second nearest‐neighbor embedded‐atom method | 3.4 | 27 | Citations (PDF) |
| 71 | A Computational Study of the Effect of Matrix Structural Order on Water Sorption by Trp-Cage Miniproteins | 2.1 | 9 | Citations (PDF) |
| 72 | Recent advances in molecular simulation: A chemical engineering perspective | 3.4 | 55 | Citations (PDF) |
| 73 | Anomalous Capacitance Maximum of the Glassy Carbon–Ionic Liquid Interface through Dilution with Organic Solvents | 3.1 | 78 | Citations (PDF) |
| 74 | Direct calculation of ice homogeneous nucleation rate for a molecular model of water | 5.3 | 241 | Citations (PDF) |
| 75 | Pathways to dewetting in hydrophobic confinement | 5.3 | 108 | Citations (PDF) |
| 76 | Systematic characterization of protein folding pathways using diffusion maps: Application to Trp-cage miniprotein | 2.2 | 59 | Citations (PDF) |
| 77 | A Comparison of the Predictive Capabilities of the Embedded-Atom Method and Modified Embedded-Atom Method Potentials for Lithium | 2.1 | 35 | Citations (PDF) |
| 78 | The liquid–liquid transition in supercooled ST2 water: a comparison between umbrella sampling and well-tempered metadynamics | 2.7 | 95 | Citations (PDF) |
| 79 | The effect of substrate on thermodynamic and kinetic anisotropies in atomic thin films | 2.2 | 37 | Citations (PDF) |
| 80 | The role of material flexibility on the drying transition of water between hydrophobic objects: A thermodynamic analysis | 2.2 | 25 | Citations (PDF) |
| 81 | Two-state thermodynamics of the ST2 model for supercooled water | 2.2 | 117 | Citations (PDF) |
| 82 | Suppression of sub-surface freezing in free-standing thin films of a coarse-grained model of water | 2.1 | 77 | Citations (PDF) |
| 83 | Viscosity of Nafion Oligomers as a Function of Hydration and Counterion Type: A Molecular Dynamics Study | 2.1 | 12 | Citations (PDF) |
| 84 | Formation kinetics of cyclopentane–methane binary clathrate hydrate | 3.9 | 45 | Citations (PDF) |
| 85 | Molecular Dynamics Simulations of Water Permeation across Nafion Membrane Interfaces | 2.1 | 33 | Citations (PDF) |
| 86 | Computational Study of the Stability of the Miniprotein Trp-Cage, the GB1 β-Hairpin, and the AK16 Peptide, under Negative Pressure | 2.1 | 40 | Citations (PDF) |
| 87 | Metastable liquid–liquid transition in a molecular model of water | 31.3 | 514 | Citations (PDF) |
| 88 | Simulations of vapor–liquid phase equilibrium and interfacial tension in the CO2–H2O–NaCl system | 3.4 | 60 | Citations (PDF) |
| 89 | Molecular Dynamics Simulations of Water Sorption in a Perfluorosulfonic Acid Membrane | 2.1 | 45 | Citations (PDF) |
| 90 | A computational investigation of attrition-enhanced chiral symmetry breaking in conglomerate crystals | 2.2 | 31 | Citations (PDF) |
| 91 | Glass Transition Thermodynamics and Kinetics | 18.1 | 261 | Citations (PDF) |
| 92 | Creation and Persistence of Chiral Asymmetry in a Microscopically Reversible Molecular Model | 2.1 | 11 | Citations (PDF) |
| 93 | Temperature and length scale dependence of solvophobic solvation in a single-site water-like liquid | 2.2 | 16 | Citations (PDF) |
| 94 | Relaxation processes in liquids: Variations on a theme by Stokes and Einstein | 2.2 | 102 | Citations (PDF) |
| 95 | A Coarse-Grained Protein Model in a Water-like Solvent | 2.7 | 14 | Citations (PDF) |
| 96 | Modeling simple amphiphilic solutes in a Jagla solvent | 2.2 | 19 | Citations (PDF) |
| 97 | Molecular modeling of mechanical stresses on proteins in glassy matrices: Formalism | 2.2 | 18 | Citations (PDF) |
| 98 | A computational investigation of the phase behavior and capillary sublimation of water confined between nanoscale hydrophobic plates | 2.2 | 41 | Citations (PDF) |
| 99 | Thermal Stability of Hydrophobic Helical Oligomers: A Lattice Simulation Study in Explicit Water | 2.1 | 0 | Citations (PDF) |
| 100 | Free Energy Barriers to Evaporation of Water in Hydrophobic Confinement | 2.1 | 65 | Citations (PDF) |
| 101 | Evaporation rate of water in hydrophobic confinement | 5.3 | 169 | Citations (PDF) |
| 102 | Massively parallel chemical potential calculation on graphics processing units | 2.8 | 27 | Citations (PDF) |
| 103 | Phase Behavior of a Lattice Hydrophobic Oligomer in Explicit Water | 2.1 | 3 | Citations (PDF) |
| 104 | Role of Hydrophobic Hydration in Protein Stability: A 3D Water-Explicit Protein Model Exhibiting Cold and Heat Denaturation | 2.1 | 62 | Citations (PDF) |
| 105 | Liquid-liquid transition in ST2 water | 2.2 | 153 | Citations (PDF) |
| 106 | Computer Simulation of Water Sorption on Flexible Protein Crystals | 3.1 | 19 | Citations (PDF) |
| 107 | Homogeneous Nucleation of Methane Hydrate in Microsecond Molecular Dynamics Simulations | 3.1 | 181 | Citations (PDF) |
| 108 | Non-monotonic dependence of water reorientation dynamics on surface hydrophilicity: competing effects of the hydration structure and hydrogen-bond strength | 2.1 | 68 | Citations (PDF) |
| 109 | Dissecting the Energetics of Hydrophobic Hydration of Polypeptides | 2.1 | 36 | Citations (PDF) |
| 110 | Evaporation Length Scales of Confined Water and Some Common Organic Liquids | 3.1 | 50 | Citations (PDF) |
| 111 | Properties of model atomic free-standing thin films | 2.2 | 41 | Citations (PDF) |
| 112 | Structure, dynamics, and thermodynamics of a family of potentials with tunable softness | 2.2 | 38 | Citations (PDF) |
| 113 | Molecular Dynamics Study of Carbon Dioxide Hydrate Dissociation | 1.9 | 134 | Citations (PDF) |
| 114 | Monte Carlo Simulations of High-Pressure Phase Equilibria of CO2–H2O Mixtures | 2.1 | 57 | Citations (PDF) |
| 115 | Waterlike glass polyamorphism in a monoatomic isotropic Jagla model | 2.2 | 51 | Citations (PDF) |
| 116 | Structure and Energetics of Thin Film Water | 2.4 | 35 | Citations (PDF) |
| 117 | Nonlinear dimensionality reduction in molecular simulation: The diffusion map approach | 2.1 | 165 | Citations (PDF) |
| 118 | Integrating diffusion maps with umbrella sampling: Application to alanine dipeptide | 2.2 | 77 | Citations (PDF) |
| 119 | Systematic determination of order parameters for chain dynamics using diffusion maps | 5.3 | 162 | Citations (PDF) |
| 120 | An Experimental and Computational Investigation of Spontaneous Lasso Formation in Microcin J25 | 1.5 | 72 | Citations (PDF) |
| 121 | Finite-size scaling study of the vapor-liquid critical properties of confined fluids: Crossover from three dimensions to two dimensions | 2.2 | 32 | Citations (PDF) |
| 122 | Chiral symmetry breaking in a microscopic model with asymmetric autocatalysis and inhibition | 2.2 | 21 | Citations (PDF) |
| 123 | Enhanced surface hydrophobicity by coupling of surface polarity and topography | 5.3 | 116 | Citations (PDF) |
| 124 | Low-temperature fluid-phase behavior of ST2 water | 2.2 | 147 | Citations (PDF) |
| 125 | Thermodynamic mechanism for solution phase chiral amplification via a lattice model | 5.3 | 31 | Citations (PDF) |
| 126 | Phase Transitions Induced by Nanoconfinement in Liquid Water | 5.8 | 236 | Citations (PDF) |
| 127 | Effect of Surface Polarity on the Structure and Dynamics of Water in Nanoscale Confinement | 2.1 | 160 | Citations (PDF) |
| 128 | Evolution from Surface-Influenced to Bulk-Like Dynamics in Nanoscopically Confined Water | 2.1 | 106 | Citations (PDF) |
| 129 | Structure–energy relations in hen egg white lysozyme observed during refolding from a quenched unfolded state | 2.9 | 10 | Citations (PDF) |
| 130 | Solubility and Molecular Conformations of n-Alkane Chains in Water | 2.1 | 143 | Citations (PDF) |
| 131 | Effect of Temperature on the Structure and Phase Behavior of Water Confined by Hydrophobic, Hydrophilic, and Heterogeneous Surfaces | 2.1 | 168 | Citations (PDF) |
| 132 | Hydrophobicity of protein surfaces: Separating geometry from chemistry | 5.3 | 256 | Citations (PDF) |
| 133 | The effect of sequence on the conformational stability of a model heteropolymer in explicit water | 2.2 | 15 | Citations (PDF) |
| 134 | A computational investigation of thermodynamics, structure, dynamics and solvation behavior in modified water models | 2.2 | 177 | Citations (PDF) |
| 135 | Structural and mechanical properties of glassy water in nanoscale confinement | 2.7 | 53 | Citations (PDF) |
| 136 | Lindemann measures for the solid-liquid phase transition | 2.2 | 100 | Citations (PDF) |
| 137 | Water-like solvation thermodynamics in a spherically symmetric solvent model with two characteristic lengths | 5.3 | 94 | Citations (PDF) |
| 138 | Structure of the first- and second-neighbor shells of simulated water: Quantitative relation to translational and orientational order | 1.6 | 122 | Citations (PDF) |
| 139 | Hydration Behavior under Confinement by Nanoscale Surfaces with Patterned Hydrophobicity and Hydrophilicity | 2.4 | 239 | Citations (PDF) |
| 140 | Effect of Surface Polarity on Water Contact Angle and Interfacial Hydration Structure | 2.1 | 494 | Citations (PDF) |
| 141 | Method for Efficient Computation of the Density of States in Water-Explicit Biopolymer Simulations on a Lattice | 1.9 | 6 | Citations (PDF) |
| 142 | A Water-Explicit Lattice Model of Heat-, Cold-, and Pressure-Induced Protein Unfolding | 1.5 | 44 | Citations (PDF) |
| 143 | Stability of proteins in the presence of carbohydrates; experiments and modeling using scaled particle theory | 1.5 | 32 | Citations (PDF) |
| 144 | Computational characterization of the sequence landscape in simple protein alphabets | 1.9 | 11 | Citations (PDF) |
| 145 | Fluid-phase behavior of binary mixtures in which one component can have two critical points | 2.2 | 58 | Citations (PDF) |
| 146 | Scaled particle theory for hard sphere pairs. I. Mathematical structure | 2.2 | 18 | Citations (PDF) |
| 147 | In Honor of Eduardo Glandt | 3.0 | 0 | Citations (PDF) |
| 148 | A conformal solution theory for the energy landscape and glass transition of mixtures | 2.1 | 17 | Citations (PDF) |
| 149 | Accurate prediction of clathrate hydrate phase equilibria below 300 K from a simple model | 3.7 | 26 | Citations (PDF) |
| 150 | Solid-State Stabilization of α-Chymotrypsin and Catalase with Carbohydrates | 3.0 | 33 | Citations (PDF) |
| 151 | Family of tunable spherically symmetric potentials that span the range from hard spheres to waterlike behavior | 1.6 | 111 | Citations (PDF) |
| 152 | Computational probes of molecular motion in the Lewis-Wahnström model for ortho-terphenyl | 2.2 | 65 | Citations (PDF) |
| 153 | Scaled particle theory for hard sphere pairs. II. Numerical analysis | 2.2 | 14 | Citations (PDF) |
| 154 | Effect of pressure on the phase behavior and structure of water confined between nanoscale hydrophobic and hydrophilic plates | 1.6 | 346 | Citations (PDF) |
| 155 | Structure, dynamics and thermodynamics in complex systems: Theoretical challenges and opportunities | 3.4 | 12 | Citations (PDF) |
| 156 | Dynamic heterogeneity and non-Gaussian behaviour in a model supercooled liquid | 1.6 | 64 | Citations (PDF) |
| 157 | Structural order in glassy water | 1.6 | 53 | Citations (PDF) |
| 158 | Effects of nonpolar solutes on the thermodynamic response functions of aqueous mixtures | 2.2 | 30 | Citations (PDF) |
| 159 | A computational study of hydration, solution structure, and dynamics in dilute carbohydrate solutions | 2.2 | 179 | Citations (PDF) |
| 160 | Computational Investigation of Order, Structure, and Dynamics in Modified Water Models† | 2.1 | 90 | Citations (PDF) |
| 161 | Novel Computational Probes of Diffusive Motion | 2.1 | 1 | Citations (PDF) |
| 162 | Alternative View of Self-Diffusion and Shear Viscosity† | 2.1 | 21 | Citations (PDF) |
| 163 | Saddles in the Energy Landscape: Extensivity and Thermodynamic Formalism | 5.8 | 25 | Citations (PDF) |
| 164 | Flat-Histogram Dynamics and Optimization in Density of States Simulations of Fluids† | 2.1 | 35 | Citations (PDF) |
| 165 | A Calorimetric and Spectroscopic Study of DNA at Low Hydration | 2.1 | 55 | Citations (PDF) |
| 166 | Simultaneous Determination of Structural and Thermodynamic Effects of Carbohydrate Solutes on the Thermal Stability of Ribonuclease A | 12.1 | 32 | Citations (PDF) |
| 167 | Differential Scanning Calorimetry Studies of Clathrate Hydrate Formation | 2.1 | 112 | Citations (PDF) |
| 168 | Thermodynamics and the glass transition in model energy landscapes | 1.6 | 20 | Citations (PDF) |
| 169 | Inherent-Structure View of Self-Diffusion in Liquids | 2.1 | 21 | Citations (PDF) |
| 170 | Phase transitions, Kauzmann curves, and inverse melting | 1.5 | 51 | Citations (PDF) |
| 171 | Quantification of order in the Lennard-Jones system | 2.2 | 140 | Citations (PDF) |
| 172 | Estimation of the Characteristic Time Scales in the Supercritical Antisolvent Process | 3.0 | 60 | Citations (PDF) |
| 173 | Supercooled and glassy water | 1.6 | 1,027 | Citations (PDF) |
| 174 | Model Energy Landscapes | 2.1 | 43 | Citations (PDF) |
| 175 | A Theoretical Study of the Interfacial Properties of Supercooled Water | 3.0 | 15 | Citations (PDF) |
| 176 | A kinetic theory of homogeneous bubble nucleation | 2.2 | 67 | Citations (PDF) |
| 177 | Energy landscapes, ideal glasses, and their equation of state | 2.2 | 57 | Citations (PDF) |
| 178 | A statistical mechanical model for inverse melting | 2.2 | 37 | Citations (PDF) |
| 179 | An improved Monte Carlo method for direct calculation of the density of states | 2.2 | 136 | Citations (PDF) |
| 180 | Supercooled and Glassy Water | 0.2 | 507 | Citations (PDF) |
| 181 | Generalization of the Wang-Landau method for off-lattice simulations | 1.6 | 211 | Citations (PDF) |
| 182 | Cooperative Origin of Low-Density Domains in Liquid Water | 5.8 | 108 | Citations (PDF) |
| 183 | Energy landscape diversity and supercooled liquid properties | 2.2 | 76 | Citations (PDF) |
| 184 | A simple molecular thermodynamic theory of hydrophobic hydration | 2.2 | 123 | Citations (PDF) |
| 185 | Molecular structural order and anomalies in liquid silica | 1.6 | 224 | Citations (PDF) |
| 186 | Energy Landscape and Isotropic Tensile Strength ofn-Alkane Glasses | 2.1 | 14 | Citations (PDF) |
| 187 | Engineering pharmaceutical stability with amorphous solids | 3.4 | 81 | Citations (PDF) |
| 188 | Mathematical modeling of nucleation and growth of particles formed by the rapid expansion of a supercritical solution under subsonic conditions | 3.0 | 97 | Citations (PDF) |
| 189 | Density-functional study of homogeneous bubble nucleation in the stretched Lennard-Jones fluid | 2.2 | 79 | Citations (PDF) |
| 190 | The Kauzmann Paradox Revisited† | 2.1 | 145 | Citations (PDF) |
| 191 | Isotropic tensile strength of molecular glasses | 2.2 | 22 | Citations (PDF) |
| 192 | Incoherent Quasi-elastic Neutron Scattering from Fructose−Water Solutions | 2.1 | 19 | Citations (PDF) |
| 193 | Relationship between structural order and the anomalies of liquid water | 31.3 | 1,561 | Citations (PDF) |
| 194 | Supercooled liquids and the glass transition | 31.3 | 4,454 | Citations (PDF) |
| 195 | Theory of supercooled liquids and glasses: Energy landscape and statistical geometry perspectives | 1.0 | 70 | Citations (PDF) |
| 196 | Thermodynamic implications of confinement for a waterlike fluid | 2.2 | 144 | Citations (PDF) |
| 197 | Numerical modeling of mass transfer in the supercritical antisolvent process: miscible conditions | 3.0 | 116 | Citations (PDF) |
| 198 | Title is missing! | 0.8 | 17 | Citations (PDF) |
| 199 | Statistical geometry of cavities in a metastable confined fluid | 1.6 | 38 | Citations (PDF) |
| 200 | Atomistic Simulation of Aging and Rejuvenation in Glasses | 5.8 | 187 | Citations (PDF) |
| 201 | Equation of state of the rigid disk fluid from its triangle distribution | 2.2 | 6 | Citations (PDF) |
| 202 | A computational study of homogeneous liquid–vapor nucleation in the Lennard-Jones fluid | 2.2 | 85 | Citations (PDF) |
| 203 | A single-bond approach to orientation-dependent interactions and its implications for liquid water | 2.2 | 160 | Citations (PDF) |
| 204 | Potential energy landscape signatures of slow dynamics in glass forming liquids | 2.1 | 50 | Citations (PDF) |
| 205 | Numerical modeling of mass transfer in the supercritical antisolvent process | 3.0 | 113 | Citations (PDF) |
| 206 | The statistical geometry of voids in liquids | 2.1 | 21 | Citations (PDF) |
| 207 | Protein purification with vapor-phase carbon dioxide 1999, 62, 247-258 | | 44 | Citations (PDF) |
| 208 | The Equation of State of an Energy Landscape | 2.1 | 110 | Citations (PDF) |
| 209 | Structure and Dynamics in Concentrated, Amorphous Carbohydrate−Water Systems by Molecular Dynamics Simulation | 2.1 | 132 | Citations (PDF) |
| 210 | Distinguishing Vibrational and Structural Equilibration Contributions to Thermal Expansion | 2.1 | 40 | Citations (PDF) |
| 211 | Free volume in the hard sphere liquid | 1.1 | 124 | Citations (PDF) |
| 212 | Signatures of distinct dynamical regimes in the energy landscape of a glass-forming liquid | 31.3 | 763 | Citations (PDF) |
| 213 | A molecular dynamics study of intermolecular structure, thermodynamics and miscibility in hydrocarbon polymers | 3.4 | 2 | Citations (PDF) |
| 214 | Liquid−Liquid Immiscibility in Single-Component Network-Forming Fluids: Model Calculations and Implications for Polyamorphism in Water | 3.0 | 13 | Citations (PDF) |
| 215 | Density fluctuations in many-body systems | 1.6 | 33 | Citations (PDF) |
| 216 | Liquid Structure, Thermodynamics, and Mixing Behavior of Saturated Hydrocarbon Polymers. 2. Pair Distribution Functions and the Regularity of Mixing | 3.9 | 39 | Citations (PDF) |
| 217 | Liquid Structure, Thermodynamics, and Mixing Behavior of Saturated Hydrocarbon Polymers. 1. Cohesive Energy Density and Internal Pressure | 3.9 | 68 | Citations (PDF) |
| 218 | Structural precursor to freezing in the hard-disk and hard-sphere systems | 1.6 | 155 | Citations (PDF) |
| 219 | Singularity-free interpretation of the thermodynamics of supercooled water. II. Thermal and volumetric behavior | 2.2 | 124 | Citations (PDF) |
| 220 | A theoretical study of Gemini surfactant phase behavior | 2.2 | 23 | Citations (PDF) |
| 221 | Resolving vibrational and structural contributions to isothermal compressibility | 2.2 | 36 | Citations (PDF) |
| 222 | Reversible work of formation of an embryo of a new phase within a uniform macroscopic mother phase | 2.2 | 72 | Citations (PDF) |
| 223 | Statistical mechanics of fluids under internal constraints: Rigorous results for the one-dimensional hard rod fluid | 1.6 | 27 | Citations (PDF) |
| 224 | Statistical geometry of particle packings. II. “Weak spots” in liquids | 1.6 | 87 | Citations (PDF) |
| 225 | Statistical geometry of particle packings. I. Algorithm for exact determination of connectivity, volume, and surface areas of void space in monodisperse and polydisperse sphere packings | 1.6 | 157 | Citations (PDF) |
| 226 | Compressibility Effects in Neutron Scattering by Polymer Blends | 3.9 | 10 | Citations (PDF) |
| 227 | Title is missing! | 2.4 | 33 | Citations (PDF) |
| 228 | Effects of Compressed Carbon Dioxide on the Phase Equilibrium and Molecular Order of a Lyotropic Polyamide Solution | 3.9 | 3 | Citations (PDF) |
| 229 | Liquid-Liquid Immiscibility in Pure Fluids: Polyamorphism in Simulations of a Network-Forming Fluid | 5.8 | 118 | Citations (PDF) |
| 230 | Compressibility Effects in the Analysis and Interpretation of Neutron Scattering Data from Polymer Blends | 3.9 | 22 | Citations (PDF) |
| 231 | Singularity-free interpretation of the thermodynamics of supercooled water | 1.6 | 530 | Citations (PDF) |
| 232 | Molecular dynamics simulation of infinitely dilute solutions of benzene in supercritical CO2 | 2.1 | 34 | Citations (PDF) |
| 233 | Supercritical fluids as solvents for chemical and materials processing | 31.3 | 905 | Citations (PDF) |
| 234 | Freeze Crystallization of Imipenem | 2.5 | 9 | Citations (PDF) |
| 235 | Precipitation of Proteins in Supercritical Carbon Dioxide | 2.5 | 190 | Citations (PDF) |
| 236 | The distribution of tetravalent network glasses | 1.1 | 60 | Citations (PDF) |
| 237 | The evaporation rate, free energy, and entropy of amorphous water at 150 K | 2.2 | 262 | Citations (PDF) |
| 238 | Polyamorphism and density anomalies in network‐forming fluids: Zeroth‐ and first‐order approximations | 2.2 | 122 | Citations (PDF) |
| 239 | The distribution of tetravalent network glasses | 1.1 | 18 | Citations (PDF) |
| 240 | Persistence time for bonds in a tetravalent network fluid | 1.1 | 25 | Citations (PDF) |
| 241 | Supercritical antisolvent process for a series of substituted para-linked aromatic polyamides | 3.9 | 32 | Citations (PDF) |
| 242 | A Lattice Model of Network-Forming Fluids with Orientation-Dependent Bonding: Equilibrium, Stability, and Implications for the Phase Behavior of Supercooled Water | 3.1 | 103 | Citations (PDF) |
| 243 | Metastability and Constraints: A Study of the Superheated Leonard-Jones Liquid in the Void-Constrained Ensemble | 3.0 | 14 | Citations (PDF) |
| 244 | The entropy of a network crystal, fluid and glass | 1.1 | 30 | Citations (PDF) |
| 245 | Thermal Expansion and Stability Limits of Generalized van der Waals Fluids | 3.1 | 2 | Citations (PDF) |
| 246 | Secondary Structure Characterization of Microparticulate Insulin Powders† | 2.5 | 67 | Citations (PDF) |
| 247 | A computational study of metastability in vapor—liquid equilibrium | 3.9 | 54 | Citations (PDF) |
| 248 | Precipitation of poly(l-lactic acid) and composite poly(l-lactic acid)-pyrene particles by rapid expansion of supercritical solutions | 3.0 | 137 | Citations (PDF) |
| 249 | Application of supercritical fluids for the production of sustained delivery devices | 8.3 | 127 | Citations (PDF) |
| 250 | Mathematical modeling of aerosol formation by rapid expansion of supercritical solutions in a converging nozzle | 2.2 | 98 | Citations (PDF) |
| 251 | Supercritical antisolvent process for substituted para-linked aromatic polyamides: phase equilibrium and morphology study | 3.9 | 82 | Citations (PDF) |
| 252 | Integral equation study of microstructure and solvation in model attractive and repulsive supercritical mixtures | 3.0 | 42 | Citations (PDF) |
| 253 | Equilibrium, stability, and density anomalies in a lattice model with core-softening and directional bonding | 3.1 | 25 | Citations (PDF) |
| 254 | Solute–solute correlations in infinitely dilute supercritical mixtures | 2.2 | 31 | Citations (PDF) |
| 255 | Molecular dynamics study of solute-solute microstructure in attractive and repulsive supercritical mixtures | 3.0 | 55 | Citations (PDF) |
| 256 | An automated Verlet neighbor list algorithm with a multiple time-step approach for the simulation of large systems | 2.8 | 9 | Citations (PDF) |
| 257 | Spinodal curve of some supercooled liquids | 3.1 | 104 | Citations (PDF) |
| 258 | Particle formation with supercritical fluids—a review | 2.2 | 338 | Citations (PDF) |
| 259 | Influence of solute-solvent asymmetry upon the behavior of dilute supercritical mixtures | 3.1 | 102 | Citations (PDF) |
| 260 | A Study of Solute-Solvent Interactions at Infinite Dilution via the Coupling Parameter Approach | 1.6 | 9 | Citations (PDF) |
| 261 | Formation of bioerodible polymeric microspheres and microparticles by rapid expansion of supercritical solutions | 1.8 | 183 | Citations (PDF) |
| 262 | On the performance of an automated Verlet neighbor list algorithm for large systems on a vector processor | 2.8 | 19 | Citations (PDF) |
| 263 | Use of the McQuarrie equation for the computation of shear viscosity via equilibrium molecular dynamics | 1.8 | 23 | Citations (PDF) |
| 264 | Homogeneous nucleation in supercritical fluids | 3.4 | 144 | Citations (PDF) |
| 265 | Letters to the editor | 3.4 | 19 | Citations (PDF) |
| 266 | On the use of the Verlet neighbor list in molecular dynamics | 2.8 | 51 | Citations (PDF) |
| 267 | Attractive, weakly attractive, and repulsive near‐critical systems | 2.2 | 157 | Citations (PDF) |
| 268 | A molecular dynamics study of the influence of elongation and quadrupole moment upon some thermodynamic and transport properties of linear heteronuclear triatomic fluids | 2.2 | 6 | Citations (PDF) |
| 269 | Fluctuation Simulations and the Calculation of Mechanical Partial Molar Properties | 1.6 | 6 | Citations (PDF) |
| 270 | Effects of process conditions on crystals obtained from supercritical mixtures | 3.4 | 104 | Citations (PDF) |
| 271 | Clustering in supercritical mixtures: Theory, applications and simulations | 2.1 | 41 | Citations (PDF) |
| 272 | Solute–solvent interactions in infinitely dilute supercritical mixtures: A molecular dynamics investigation | 2.2 | 205 | Citations (PDF) |
| 273 | A novel fused metal anode solid electrolyte fuel cell for direct coal gasification: a steady-state model [Erratum to document cited in CA111(12):100114u] | 3.0 | 0 | Citations (PDF) |
| 274 | A novel fused metal anode solid electrolyte fuel cell for direct coal gasification: a steady-state model | 3.0 | 25 | Citations (PDF) |
| 275 | Fluctuation‐based computer calculation of partial molar properties. II. A numerically accurate method for the determination of partial molar energies and enthalpies | 2.2 | 20 | Citations (PDF) |
| 276 | Thermodynamic stability of single‐phase fluids and fluid mixtures under the influence of gravity | 2.2 | 9 | Citations (PDF) |
| 277 | Loss of tensile strength in liquids without property discontinuities: A thermodynamic analysis | 2.2 | 42 | Citations (PDF) |
| 278 | Fluctuation‐based computer calculation of partial molar properties. I. Molecular dynamics simulation of constant volume fluctuations | 2.2 | 32 | Citations (PDF) |
| 279 | The statistical mechanical theory of concentration fluctuations in mixtures | 2.2 | 12 | Citations (PDF) |
| 280 | Clustering in dilute, binary supercritical mixtures: A fluctuation analysis | 3.9 | 169 | Citations (PDF) |
| 281 | Derivation of operational definitions for the computer calculation of partial molar properties in multicomponent mixtures | 2.1 | 7 | Citations (PDF) |
| 282 | On the relationship between principal fluctuations and stability coefficients in multicomponent systems | 2.2 | 28 | Citations (PDF) |
| 283 | On the entropy changes and fluctuations occurring near a tensile instability | 2.2 | 28 | Citations (PDF) |
| 284 | Generalized Massieu–Planck functions: Geometric representation, extrema and uniqueness properties | 2.2 | 5 | Citations (PDF) |
| 285 | On the nature of the tensile instability in metastable liquids and its relationship to density anomalies | 2.2 | 50 | Citations (PDF) |
| 286 | Cross-flow, solid-state electrochemical reactors: a steady state analysis | 0.6 | 54 | Citations (PDF) |
| 287 | Energy landscape statistics and thermodynamics of a machine-learned model of water | 5.3 | 0 | Citations (PDF) |
