Journal of Physical Chemistry B

Journal of Physical Chemistry B, Vol.112, No.4 Entire volume, number list

ISSN: 1520-6106 (Print)

In this Issue (38 articles)

1049 - 1052	Solvation in mixed aqueous solvents from a thermodynamic cycle approach Shah PP, Roberts CJ
1053 - 1056	Spin states at a tipping point: What determines the d(z)(2l) ground state of nickel(III) Tetra((t)butyl)porphyrin dicyanide? Conradie J, Wondimagegn T, Ghosh A
1057 - 1059	The catalytic activity of proline racemase: A quantum mechanical/molecular mechanical study Stenta M, Calvaresi M, Altoe P, Spinelli D, Garavelli M, Bottoni A
1060 - 1064	DNA double helices recognize mutual sequence homology in a protein free environment Baldwin GS, Brooks NJ, Robson RE, Wynveen A, Goldar A, Leikin S, Seddon JM, Kornyshev AA
1065 - 1070	Influence of a crown ether comonomer on the temperature-induced phase transition of Poly(N-isopropylacrylamide) hydrogels Kosik K, Wilk E, Geissler E, Laszlo K
1071 - 1081	Threading, growth, and aggregation of pseudopolyrotaxanes Lo Nostro P, Giustini L, Fratini E, Ninham BW, Ridi F, Baglioni P
1082 - 1089	Intramolecular and intermolecular association during chemical cross-linking of dilute solutions of different polysaccharides under the influence of shear flow Liu Z, Maleki A, Zhu K, Kjoniksen AL, Nystrom B
1090 - 1094	Structures and considerable static first hyperpolarizabilities: New organic alkalides (M+@n(6)adz)M'(-)(M, M' = Li, Na, K; n=2, 3) with cation inside and anion outside of the cage complexants Wang FF, Li ZR, Wu D, Wang BQ, Li Y, Li ZJ, Chen W, Yu GT, Gu FL, Aoki Y
1095 - 1103	Crystal structure of nitromethane up to the reaction threshold pressure Citroni M, Datchi F, Bini R, Di Vaira M, Pruzan P, Canny B, Schettino V
1104 - 1111	Excited state properties of oligophenyl and oligothienyl swivel cruciforms Pina J, de Melo JS, Burrows HD, Galbrecht F, Bilge A, Kudla CJ, Scherf U
1112 - 1118	A novel thermoresponsive hydrogel with ion-recognition property through supramolecular host-guest complexation Ju XJ, Chu LY, Liu L, Mi P, Lee YM
1119 - 1129	Probing the pi-stacking induced molecular aggregation in pi-conjugated polymers, oligomers, and their blends of p-phenylenevinylenes Arnrutha SR, Jayakannan M
1130 - 1134	Tunable thermoassociation of binary guanosine gels Yu Y, Nakamura D, DeBoyace K, Neisius AW, McGown LB
1135 - 1148	Diffusion of H through Pd-Ag alloys (423-523 K) Wang D, Flanagan TB, Shanahan K
1149 - 1156	CTAB-promoted Prussian blue-modified electrode and its cation transport characteristics for K+, Na+, Li+, and NH4+ ions Vittal R, Kim KJ, Gomathi H, Yegnaraman V
1157 - 1162	Formation of polyaniline nanofibers: A morphological study Wang YY, Jing XL
1163 - 1169	Fabrication of spatially periodic double roughness structures by directional viscous fingering and spinodal dewetting for water-repellent surfaces Kuroda A, Ishihara T, Takeshige H, Asakura K
1170 - 1176	Advection of chemical reaction fronts in a porous medium Koptyug IV, Zhivonitko VV, Sagdeev RZ
1177 - 1183	Calculation of activities of ions in molten salts with potential application to the pyroprocessing of nuclear waste Salanne M, Simon C, Turq P, Madden PA
1184 - 1188	1,1-dichloroethane: A molecular crystal structure without van der waals contacts? Bujak M, Podsiadlo M, Katrusiak A
1189 - 1197	Quaternary ammonium room-temperature ionic liquid including an oxygen atom in side chain/lithium salt binary electrolytes: Ionic conductivity and H-1, Li-7, and F-19 NMR studies on diffusion coefficients and local motions Hayamizu K, Tsuzuki S, Seki S, Ohno Y, Miyashiro H, Kobayashi Y
1198 - 1211	An efficient Monte Carlo algorithm for the fast equilibration and atomistic simulation of alkanethiol self-assembled monolayers on a Au(111) substrate Alexiadis O, Daoulas KC, Mavrantzas VG
1212 - 1217	Osmotic coefficients of electrolyte solutions Moggia E
1218 - 1225	Phase equilibria and modeling of ammonium ionic liquid, C2NTf2, solutions Domanska U, Marciniak A, Krolikowski M
1226 - 1231	Probing the porosity of cocrystallized MCM-49/ZSM-35 zeolites by hyperpolarized Xe-129 NMR Liu Y, Zhang WP, Xie SJ, Xu L, Han XW, Bao XH
1232 - 1239	Effect of temperature on excited-state proton Tunneling in wt-green fluorescent protein Leiderman P, Gepshtein R, Tsimberov I, Huppert D
1240 - 1250	Ab initio comprehensive conformational analysis of 2'-Deoxyuridine, the biologically significant DNA minor nucleoside, and reconstruction of its low-temperature matrix infrared spectrum Yurenko YP, Zhurakivsky RO, Ghomi M, Samifflenko SP, Hovorun DM
1251 - 1261	Interaction of a tripeptide with cesium perfluorooctanoate micelles Pizzanelli S, Fortc C, Monti S, Schweitzer-Stenner R
1262 - 1266	Existence of oriented ion-hydroxide clusters in concentrated aqueous NaCl solution at pH 13 Aziz EF, Eisebitt S, Eberhardt W, Cwiklik L, Jungwirth P
1267 - 1274	NMR chemical shifts of the rhodopsin chromophore in the dark state and in bathorhodopsin: A hybrid QM/MM molecular dynamics study Rohrig UF, Sebastiani D
1275 - 1281	Fabrication of a label-free electrochemical immunosensor of low-density lipoprotein Yan W, Chen XJ, Li XH, Feng XM, Zhu JJ
1282 - 1289	Vibrational analysis of amino acids and short peptides in hydrated media. 3. Successive KL repeats induce highly stable beta-strands capable of forming non-H-bonded aggregates Guiffo-Soh G, Hernandez B, Coic YM, Boukhalfa-Henichet FZ, Faddat G, Ghomi M
1290 - 1292	Identifying receptor-ligand interactions through an ab initio approach Salazar PF, Seminario JM
1293 - 1298	Quantum mechanical calculations on selectivity in the KcsA channel: The role of the aqueous cavity Kariev AM, Green ME
1299 - 1307	Intermolecular vibrational coherence in the bacteriochlorophyll proteins B777 and B820 from Rhodospirillum rubrum Shelly KR, Golovich EC, Dillman KL, Beck WF
1308 - 1314	Nucleation, growth, and form in crystals of peptide helices Vasudev PG, Shamala N, Balaram P
1315 - 1319	Incorporation of the HERG potassium channel in a mercury supported lipid bilayer Becucci L, Carbone MV, Biagiotti T, D'Amico M, Olivotto M, Guidelli R
1320 - 1328	Amide I vibrational frequencies of alpha-helical peptides based upon ONIOM and density functional theory (DFT) studies Wimorek R, Dannenberg JJ