화학공학소재연구정보센터

Journal of Physical Chemistry B

Journal of Physical Chemistry B, Vol.123, No.24 Entire volume, number list
ISSN: 1520-6106 (Print) 

In this Issue (18 articles)

5015 - 5023 Effects of Intrinsic Local Fields on Molecular Fluorescence and Energy Transfer: Dipole Mechanisms and Surface Potentials
Andrews DL
5024 - 5034 A Hierarchical Approach to Predict Conformation-Dependent Histidine Protonation States in Stable and Flexible Proteins
Sakipov SN, Flores-Canales JC, Kurnikova MG
5035 - 5047 Assessing Possible Mechanisms of Micrometer-Scale Electron Transfer in Heme-Free Geobacter sulfurreducens Pili
Ru XY, Zhang P, Beratan DN
5048 - 5058 Dynamic Nuclear Polarization Magic-Angle Spinning Nuclear Magnetic Resonance Combined with Molecular Dynamics Simulations Permits Detection of Order and Disorder in Viral Assemblies
Gupta R, Zhang HL, Lu MM, Hou GJ, Caporini M, Rosay M, Maas W, Struppe J, Ahn J, Byeon IJL, Oschkinat H, Jaudzems K, Barbet-Massin E, Emsley L, Pintacuda G, Lesage A, Gronenborn AM, Polenova T
5059 - 5068 Implications of a Water Molecule for Photoactivation of Plant (6-4) Photolyase
Hosokawa Y, Sato R, Iwai S, Yamamoto J
5069 - 5078 Effect of Correlated Pair Mutations in Protein Misfolding
Kumar A, Biswas P
5079 - 5085 4-Oxoproline as a Site-Specific Infrared Probe: Application To Assess Proline Isomerization and Dimer Formation
Abaskharon RM, Mukherjee D, Gai F
5086 - 5098 Mechanistic Insights from Replica Exchange Molecular Dynamics Simulations into Mutation Induced Disordered-to-Ordered Transition in Hahellin, a beta gamma-Crystallin
Patel S, Krishnan B, Hosur RV, Chary KVR
5099 - 5106 Finite-Size-Corrected Rotational Diffusion Coefficients of Membrane Proteins and Carbon Nanotubes from Molecular Dynamics Simulations
Vogele M, Kofinger J, Hummer G
5107 - 5120 3D Tracking-Free Approach for Obtaining 3D Super-Resolution Information in Rotationally Symmetric Biostructures
Ruba A, Luo WX, Kelich J, Tingey M, Yang WD
5121 - 5130 Investigation of the Structure of Concentrated NaOH Aqueous Solutions by Combining Molecular Dynamics and Wide-Angle X-ray Scattering
Coste A, Poulesquen A, Diat O, Dufreche JF, Duvail M
5131 - 5138 Computational Insights into Endo/Exo Selectivity of the Diels-Alder Reaction in Explicit Solvent at Ab Initio Quantum Mechanical/Molecular Mechanical Level
Li PF, Liu FJ, Shao YH, Mei Y
5139 - 5146 OH-Stretch Raman Multivariate Curve Resolution Spectroscopy of HOD/H2O Mixtures
Kananenka AA, Hestand NJ, Skinner JL
5147 - 5159 Triborate Formation Constants and Polyborate Speciation under Hydrothermal Conditions by Raman Spectroscopy using a Titanium/Sapphire Flow Cell
Sasidharanpillai S, Arcis H, Trevani L, Tremaine PR
5160 - 5167 Why Is Pristine PEDOT Oxidized to 33%? A Density Functional Theory Study of Oxidative Polymerization Mechanism
Kim D, Zozoulenko I
5168 - 5175 Water-Responsive and Mechanically Adaptive Natural Rubber Composites by in Situ Modification of Mineral Filler Structures
Banerjee SS, Hait S, Natarajan TS, Wiessner S, Stockelhuber KW, Jehnichen D, Janke A, Fischer D, Heinrich G, Busfield JJC, Das A
5176 - 5180 Molecular Dynamics Study on Dynamical Features of Reorganization Process for Nanocapsule Formed with Gear-Shaped Amphiphile Molecules
Mashiko T, Hiraoka S, Nagashima U, Tachikawa M
5181 - 5188 Dynamic Heterogeneities in Colloidal Supercooled Liquids: Experimental Tests of Inhomogeneous Mode Coupling Theory
Mishra CK, Habdas P, Yodh AG