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