| 1125 - 1136 |
Molecular Details of a Salt Bridge and Its Role in Insulin Fibrillation by NMR and Raman Spectroscopic Analysis
Ratha BN, Kar RK, Bednarikova Z, Gazova Z, Kotler SA, Raha S, De S, Maiti NC, Bhunia A |
| 1137 - 1147 |
Using Atomic Confining Potentials for Geometry Optimization and Vibrational Frequency Calculations in Quantum-Chemical Models of Enzyme Active Sites
Dasgupta S, Herbert JM |
| 1148 - 1159 |
Variation of Energy Transfer Rates across Protein-Water Contacts with Equilibrium Structural Fluctuations of a Homodimeric Hemoglobin
Reid KM, Yamato T, Leitner DM |
| 1160 - 1174 |
Oxidized Derivatives of 5-Methylcytosine Alter the Stability and Dehybridization Dynamics of Duplex DNA
Sanstead PJ, Ashwood B, Dai Q, He C, Tokmakoff A |
| 1175 - 1182 |
Impact of A2T and D23N Mutations on Tetrameric A beta 42 Barrel within a Dipalmitoylphosphatidylcholine Lipid Bilayer Membrane by Replica Exchange Molecular Dynamics
Ngo ST, Nguyen PH, Derreumaux P |
| 1183 - 1196 |
Characterization of Specific Ion Effects on PI(4,5)P-2 Clustering: Molecular Dynamics Simulations and Graph-Theoretic Analysis
Han K, Gericke A, Pastor RW |
| 1197 - 1206 |
Deep Eutectic Solvent Reline at 2D Nanomaterial Interfaces
Rozas S, Atilhan M, Aparicio S |
| 1207 - 1217 |
Augmented Scaled Particle Theory
Qao CZ, Zhao SL, Liu HL, Dong W |
| 1218 - 1228 |
Inclusion Complexation of Organic Micropollutants with beta-Cyclodextrin
Erdos M, Hartkamp R, Vlugt TJH, Moultos OA |
| 1229 - 1239 |
Structural Properties and Hydrogen-Bonding Interactions in Binary Mixtures Containing a Deep-Eutectic Solvent and Acetonitrile
Kalhor P, Jing X, Ashraf H, Cao BB, Yu ZW |
| 1240 - 1244 |
Structurally Related Scaling Behavior in Ionic Systems
Cheng S, Musial M, Wojnarowska Z, Holt A, Roland CM, Drockenmuller E, Paluch M |
| 1245 - 1252 |
Solvate Cation Migration and Ion Correlations in Solvate Ionic Liquids
Schmidt F, Schonhoff M |
| 1253 - 1258 |
Connections between the Speciation and Solubility of Ni(II) and Co(II) in Molten ZnCl2
Gill SK, Huang JH, Mausz J, Gakhar R, Roy S, Vila F, Topsakal M, Phillips WC, Layne B, Mahurin S, Halstenberg P, Dai S, Wishart JF, Bryantsev VS, Frenkel AI |
| 1259 - 1265 |
Microheterogeneity in Aqueous Acetonitrile Solution Probed by Soft X-ray Absorption Spectroscopy
Nagasaka M, Yuzawa H, Kosugi N |
| 1266 - 1274 |
Evaporative Drying of Sodium Chloride Solution Droplet on a Thermally Controlled Substrate
Basu N, Mukherjee R |
| 1275 - 1284 |
Efficient Phase Diagram Sampling by Active Learning
Dai CY, Bruss IR, Glotzer SC |
| 1285 - 1292 |
Driving Force for the Complexation of Charged Polypeptides
Singh AN, Yethiraj A |
| 1293 - 1300 |
Influence of Substrate Surface Properties on Spin Dewetting, Texture, and Phase Transitions of 5CB Liquid-Crystal Thin Films
Dhara P, Mukherjee R |
| 1301 - 1310 |
Sorption and Diffusion of Methane and Carbon Dioxide in Amorphous Poly(alkyl acrylates): A Molecular Simulation Study
Yang YF, Nair AKN, Sun SY |
| 1311 - 1321 |
Electric Fields at Metal-Surfactant Interfaces: A Combined Vibrational Spectroscopy and Capacitance Study
Sarkar S, Maitra A, Banerjee S, Thoi VS, Dawlaty JM |
