Journal of Physical Chemistry B

Journal of Physical Chemistry B, Vol.114, No.29 Entire volume, number list

ISSN: 1520-6106 (Print)

In this Issue (46 articles)

9323 - 9329	Density Functional Theory Analysis of Raman Frequency Modes of Monoclinic Zirconium Oxide Using Gaussian Basis Sets and Isotopic Substitution Daramola DA, Muthuvel M, Botte GG
9330 - 9337	Kinetics of Spontaneous Formation of Chiral J-Aggregate of N-Sulfobutyl Oxacarbocyanine Gorner H, Slavnova TD, Chibisov AK
9338 - 9348	Extended Apolar beta-Peptide Foldamers: The Role of Axis Chirality on beta-Peptide Sheet Stability Pohl G, Beke T, Csizmadia IG, Perczel A
9349 - 9355	Molecular Dynamics Simulations of Polymers with Stiff Backbones Interacting with Single-Walled Carbon Nanotubes Tallury SS, Pasquinelli MA
9356 - 9366	DNA-Poly(diallyldimethylammonium chloride) Complexation and Transfection Efficiency Alatorre-Meda M, Taboada P, Krajewska B, Willemeit M, Deml A, Klosel R, Rodriguez JR
9367 - 9380	Experimental and Theoretical Investigation of Effect of Spacer Arm and Support Matrix of Synthetic Affinity Chromatographic Materials for the Purification of Monoclonal Antibodies Zamolo L, Salvalaglio M, Cavallotti C, Galarza B, Sadler C, Williams S, Hofer S, Horak J, Lindner W
9381 - 9390	Infrared and Water Sorption Studies of the Hydration Structure and Mechanism in Natural and Synthetic Melanin Bridelli MG, Crippa PR
9391 - 9399	Detailed Molecular Dynamics Simulations of a Model NaPSS in Water Carrillo JMY, Dobrynin AV
9400 - 9412	Heavy Atom Substitution Effects in Non-Aromatic Ionic Liquids: Ultrafast Dynamics and Physical Properties Shirota H, Fukazawa H, Fujisawa T, Wishart JF
9413 - 9419	Single- and Multiphoton Turn-On Fluorescent Fe3+ Sensors Based on Bis(rhodamine) Weerasinghe AJ, Schmiesing C, Varaganti S, Ramakrishna G, Sinn E
9420 - 9428	Nitromethane Decomposition under High Static Pressure Citroni M, Bini R, Pagliai M, Cardini G, Schettino V
9429 - 9434	Nitrogen-Rich Carbon Nitride Hollow Vessels: Synthesis, Characterization, and Their Properties Li YG, Zhang JA, Wang QS, Jin YX, Huang DH, Cui QL, Zou GT
9435 - 9444	Comparison Study of Morphology and Crystallization Behavior of Polyethylene and Poly(ethylene oxide) on Single-Walled Carbon Nanotubes Zheng XL, Xu Q
9445 - 9451	Structural Convergence Among Diverse, Toxic beta-Sheet Ion Channels Jang H, Arce FT, Ramachandran S, Capone R, Lal R, Nussinov R
9452 - 9461	Mechanism of N(5)-Ethyl-flavinium Cation Formation Upon Electrochemical Oxidation of N(5)-Ethyl-4a-hydroxyflavin Pseudobase Sichula V, Hu Y, Mirzakulova E, Manzer SF, Vyas S, Hadad CM, Glusac KD
9462 - 9473	Interaction Mechanism of Cortisol and Catecholamines with Structural Components of Erythrocyte Membranes Panin LE, Mokrushnikov PV, Kunitsyn VG, Zaitsev BN
9474 - 9484	Grazing Incidence Diffraction and X-ray Reflectivity Studies of the Interactions of Inorganic Mercury Salts with Membrane Lipids in Langmuir Mono layers at the Air/Water Interface Broniatowski M, Flasinski M, Dynarowicz-Latka P, Majewski J
9485 - 9495	Na+ and Ca2+ Effect on the Hydration and Orientation of the Phosphate Group of DPPC at Air-Water and Air-Hydrated Silica Interfaces Casillas-Ituarte NN, Chen XK, Castada H, Allen HC
9496 - 9503	Time Resolved Studies of Interfacial Reactions of Ozone with Pulmonary Phospholipid Surfactants Using Field Induced Droplet Ionization Mass Spectrometry Kim HI, Kim H, Shin YS, Beegle LW, Goddard WA, Heath JR, Kanik I, Beauchamp JL
9504 - 9509	Mechanism of Interaction of Monovalent Ions with Phosphatidylcholine Lipid Membranes Vacha R, Jurkiewicz P, Petrov M, Berkowitz ML, Bockmann RA, Barucha-Kraszewska J, Hof M, Jungwirth P
9510 - 9515	Small-Angle Orientational Motions of Spin-Labeled Lipids in Cholesterol-Containing Bilayers Studied at Low Temperatures by Electron Spin Echo Spectroscopy Isaev NP, Syryamina VN, Dzuba SA
9516 - 9524	Free-Energy-Based Methods for Binding Profile Determination in a Congeneric Series of CDK2 Inhibitors Fidelak J, Juraszek J, Branduardi D, Bianciotto M, Gervasio FL
9525 - 9539	Absolute Binding Free Energy Calculations of Sparsomycin Analogs to the Bacterial Ribosome Ge XX, Roux B
9540 - 9545	Glass Forming Region of Cu-Ti-Hf Ternary Metal System Derived from the n-Body Potential through Molecular Dynamics Simulation Liang SH, Dai Y, Li JH, Liu BX
9546 - 9554	Hummer and Szabo-like Potential of Mean Force Estimator for Bidirectional Nonequilibrium Pulling Experiments/Simulations Nicolini P, Procacci P, Chelli R
9555 - 9562	Structure and Dynamics of Concentrated Hydrochloric Acid Solutions Xu JQ, Izvekov S, Voth GA
9563 - 9571	Crystal Growth Simulations of H2S Hydrate Liang SA, Kusalik PG
9572 - 9577	Relations between the Fractional Stokes-Einstein and Nernst-Einstein Equations and Velocity Correlation Coefficients in Ionic Liquids and Molten Salts Harris KR
9578 - 9585	Fictive Temperature, Structural Relaxation, and Reality of Residual Entropy Aji DPB, Johari GP
9586 - 9593	Preferential Solvation and Behavior of Solvatochromic Indicators in Mixtures of an Ionic Liquid with Some Molecular Solvents Salari H, Khodadadi-Moghaddam M, Harifi-Mood AR, Gholami MR
9594 - 9601	Local Effects in the X-ray Absorption Spectrum of Salt Water Kulik HJ, Marzari N, Correa AA, Prendergast D, Schwegler E, Galli G
9602 - 9607	A Simplified van der Waals-Platteeuw Model of Clathrate Hydrates with Multiple Occupancy of Cavities Martin A
9608 - 9616	Molecular Simulations Reveal the Mechanism and the Determinants for Ampicillin Trans location through OmpF Kumar A, Hajjar E, Ruggerone P, Ceccarelli M
9617 - 9621	The Fate of H Atom Adducts to 3'-Uridine Monophosphate Wang R, Zhang RB, Eriksson LA
9622 - 9628	Catalytic Mechanism of Hydroxynitrile Lyase from Hevea brasiliensis: A Theoretical Investigation Cui FC, Pan XL, Liu JY
9629 - 9644	Structural Variability and the Nature of Intermolecular Interactions in Watson-Crick B-DNA Base Pairs Czyznikowska Z, Gora RW, Zalesny R, Lipkowski P, Jarzembska KN, Dominiak PM, Leszczynski J
9645 - 9652	Electronic Structure of Genomic DNA: A Photoemission and X-ray Absorption Study Kummer K, Vyalikh DV, Gavrila G, Preobrajenski AB, Kick A, Bonsch M, Mertig M, Molodtsov SL
9653 - 9662	Theoretical Investigation of Hydrogen Atom Transfer in the Cytosine-Guanine Base Pair and Its Coupling with Electronic Rearrangement. Concerted vs Stepwise Mechanism Villani G
9663 - 9676	Computational Mutation Scanning and Drug Resistance Mechanisms of HIV-1 Protease Inhibitors Hao GF, Yang GF, Zhan CG
9677 - 9683	The Ultraviolet Absorption Coefficient of Melanosomes Decreases with Increasing Pheomelanin Content Peles DN, Simon JD
9684 - 9690	Two-Photon Absorption Properties of Cationic 1,4-Bis(styryl)benzene Derivative and Its Inclusion Complexes with Cyclodextrins Nag OK, Nayak RR, Lim CS, Kim IH, Kyhm K, Cho BR, Woo HY
9691 - 9697	Protein Phosphorescence Quenching: Distinction between Quencher Penetration and External Quenching Mechanisms Strambini GB, Gonnelli M
9698 - 9705	The Mechanism of Cyclization in Chromophore Maturation of Green Fluorescent Protein: A Theoretical Study Ma YY, Sun QA, Zhang H, Peng LA, Yu JG, Smith SC
9706 - 9712	A Computational Study on the Acidity Dependence of Radical-Scavenging Mechanisms of Anthocyanidins Estevez L, Otero N, Mosquera RA
9713 - 9719	Electrooxidative Decarboxylation of Vanillylmandelic Acid: Voltammetric Differentiation between the Structurally Related Compounds Homovanillic Acid and Vanillylmandelic Acid Li QA, Batchelor-McAuley C, Compton RG
9720 - 9720	Multistep Crystal Nucleation: A Kinetic Study Based on Colloidal Crystallization (vol 111B, pg 14001, 2007) Zhang TH, Liu XY