1 - 7 |
A hypothetical mechanism for HIV-1 integrase catalytic action: DFT modelling of a bio-mimetic environment Bernardi F, Bottoni A, De Vivo M, Garavelli M, Keseru G, Naray-Szabo G |
8 - 12 |
Formation of periodic precipitation patterns: a moving boundary problem George J, Varghese G |
13 - 18 |
F-19 NMR chemical shielding for metal fluorides MF2 (M = Zn, Cd, Pb), MF3 (M = Al, Ga, In) and SnF4 Cai SH, Chen Z, Chen ZW, Wan HL |
19 - 25 |
Mass analyzed threshold ionization spectroscopy of p-ethylaniline cation: alkyl chain effects on ionization and molecular vibration Yang SC, Lin JL, Tzeng WB |
26 - 30 |
Nonlinear optical property of hemicyanine self-assembled monolayers on gold and its adsorption kinetics probed by optical second-harmonic generation and surface plasmon resonance spectroscopy Naraoka R, Kaise G, Kajikawa K, Okawa H, Ikezawa H, Hashimoto K |
31 - 38 |
Ultrafast expansion and vibrational coherences of electronic'Bubbles' in solid neon Vigliotti F, Bonacina L, Chergui M, Rojas-Lorenzo G, Rubayo-Soneira J |
39 - 46 |
Density functional theory direct dynamics study on the hydrogen abstraction reaction of CF3CHFCF3+OH -> CF3CFCF3+H2O Liu JY, Li ZS, Dai ZW, Huang XR, Sun CC |
47 - 50 |
Generation of giant carbon hollow spheres from C-60 fullerene by shock-compression Niwase K, Homae T, Nakamura KG, Kondo K |
51 - 55 |
Noise-enhanced energy transduction of molecular machinery Wang ZW, Hou ZH, Xin HW |
56 - 62 |
Numerical analysis of gas-phase diffusion resistance in a droplet train apparatus Sugiyama M, Koda S, Morita A |
63 - 71 |
The solution dynamics of photoinduced geminate radical ion pairs: free ion formation Zhou JW, Findley BR, Francis TM, Nytko EA, Braun CL |
72 - 78 |
A new hybrid functional including a meta-GGA approach Toulouse J, Adamo C |
79 - 84 |
SBSL dynamics for bubbles modified by surfactants Yanagita H, Abe Y, Nakabayashi S |
85 - 89 |
Structural and theoretical investigations of short hydrogen bonds: neutron diffraction and plane-wave DFT calculations of urea-phosphoric acid Wilson CC, Morrison CA |
90 - 96 |
Absorption and Raman spectroscopy of mass-selected scandium tetramers in argon matrices Zhao B, Lu HY, Jules J, Lombardi JR |
97 - 102 |
Spontaneous magnetization below 44 K in (benzo[1,2-d : 4,5-d']bis[1,3,2]dithiazole) center dot FeCl4 driven by evaporation of crystal solvent Fujita W, Awaga K, Takahashi M, Takeda M, Yamazaki T |
103 - 108 |
Strong chiroptical effects in surface second harmonic generation obtained for molecules exhibiting excitonic coupling chirality Schanne-Klein MC, Boulesteix T, Hache F, Alexandre M, Lemercier G, Andraud C |
109 - 113 |
Linkage isomerism of carbonyl coordination complexes formed upon CO adsorption on the zeolite Li-ZSM-5: variable-temperature FTIR studies Arean CO, Delgado MR, Manoilova OV, Palomino GT, Tsyganenko AA, Garrone E |
114 - 118 |
Enhanced magnetoresistance at high temperatures in La0.7Sr0.3MnO3/silica nanocomposites Huang YH, Wang S, Luo F, Jiang S, Yan CH |
119 - 122 |
Synthesis of NiO nanorods by a novel simple precursor thermal decomposition approach Wang WZ, Liu YK, Xu CK, Zheng CL, Wang GH |
123 - 129 |
Structure and kinetics of the intermediate biradicals generated from intramolecular electron transfer reaction of FAD studied by an action spectrum of the magnetic field effect Murakami M, Maeda K, Arai T |
130 - 134 |
Study of charge generation process in some photosensitizing rhenium diimine complexes Lam LSM, Chan WK, Djurisic AB, Li EH |
135 - 143 |
Dispersing and coating of transition metals Co, Fe and Ni on carbon materials Zhong ZY, Liu BH, Sun LF, Ding J, Lin JY, Tan KL |
144 - 150 |
Argon multilayers on a corrugated surface: effect of coverage on structure Khandkar MD, Balasubramanian S |
151 - 158 |
Topotactic valence manipulation to design strontium manganate: a first principle study Chatterjee A, Onodera Y, Ebina T, Iwasaki T |
159 - 164 |
Green's function matrix elements and charge transfer on the CnNH center dot center dot center dot CnNH and CnNH center dot center dot center dot NCnH (n=1 and 3) hydrogen bonded complexes Parnaiba-daSilva AJ, da Silva JBP, da Gama AAS, Ramos MN |
165 - 169 |
Large third-order nonlinear optical response of conjugated copolymers consisting of fluorene and carbazole units Zhan XW, Liu YQ, Zhu DB, Liu XC, Xu G, Ye PX |
170 - 178 |
Efficient use of the resolution of the identity approximation in time-dependent density functional calculations with hybrid density functionals Neese F, Olbrich G |
179 - 180 |
Switching from intramolecular energy transfer to intramolecular electron transfer by the action of pH and Zn2+ co-ordination (vol 353, pg 63, 2002) Pina F |