209 - 215 |
Enzyme functionality and solvation of Subtilisin Carlsberg: from hours to femtoseconds Kamal JKA, Xia TB, Pal SK, Zhao L, Zewail AH |
216 - 220 |
Cumulative reaction probability N(E) as estimated from empirical bimolecular rate constant k(T) Sato S |
221 - 226 |
Caging enzyme function: alpha-chymotrypsin in reverse micelle Biswas R, Pal SK |
227 - 232 |
Hybrid adaptive grid algorithm for wave packet propagation Babyuk D, Wyatt RE |
233 - 237 |
Stability of high-energy nitrogen-rich sulfides S(N-4)(m) Wang LJ, Mezey PG |
238 - 242 |
A QSPR study on optical limiting of organic compounds Lind P, Lopes C, Oberg K, Eliasson B |
243 - 246 |
Some predicted relationships and properties for the charge distribution in crambin Ritchie JP |
247 - 252 |
Mechanical behavior of functionalized nanotubes Namilae S, Chandra N, Shet C |
253 - 257 |
Polarizability of Fe-n (n <= 4) clusters: an all-electron density functional study Calaminici P |
258 - 262 |
Fluorescence from the second excited singlet state of 3-hydroxyflavone in supercritical CO2 Chattopadhyay N, Barroso M, Serpa C, Arnaut LG, Formosinho SJ |
263 - 266 |
Photophysics of 3-hydroxyflavone in supercritical CO2: a probe to study the micro environment of SCF Chattopadhyay N, Barroso M, Serpa C, Silva MI, Arnaut LG, Formosinho SJ |
267 - 270 |
Thymine excision from DNA by subexcitation electrons Abdoul-Carime H, Gohlke S, Fischbach E, Scheike J, Illenberger E |
271 - 276 |
Ab initio study of CNT NO2 gas sensor Peng S, Cho KJ, Qi PF, Dai HJ |
277 - 282 |
A Lanczos-powered implementation of the Faber polynomial quantum time propagator for reaction probabilities Rasmussen AJ, Smith SC |
283 - 286 |
Inhibition of one-electron oxidation of 1-pyrenesulfonate included in cyclodextrin by sulfate radical anion Hara M, Tojo S, Majima T |
287 - 294 |
Multiplex integrated cavity output spectroscopy of cold PAH cations Biennier L, Salama F, Gupta M, O'Keefe A |
295 - 300 |
Molecular self-diffusion measurement by stimulated echo of selected C-13-H-1 bonds: case of the glucose metabolites Casieri C, Testa C, Paci M, De Luca F |
301 - 306 |
Resonant Raman spectra of carbon nanotube bundles observed by perpendicularly polarized light Gruneis A, Saito R, Jiang J, Samsonidze GG, Pimenta MA, Jorio A, Souza AG, Dresselhaus G, Dresselhaus MS |
307 - 311 |
CFD prediction of carbon nanotube production rate in a CVD reactor Endo H, Kuwana K, Saito K, Qian D, Andrews R, Grulke EA |
312 - 316 |
Reactions of amide group with fluorine as revealed with surface analytics Solomun T, Schimanski A, Sturm H, Illenberger E |
317 - 321 |
Current function for irreversible electron transfer processes in linear sweep voltammetry for the reactions obeying Marcus kinetics Prasad MA, Sangaranarayanan MV |
322 - 326 |
On the origin of hydrogen in the formaldehyde reaction in alkaline solution Kapoor S, Naumov S |
327 - 331 |
An ESR study of dynamic biradicals of two TEMPOs bridged with -(SiMe2)(n)- (n=1-4) in liquid solution Komaguchi K, Iida T, Goh Y, Ohshita J, Kunai A, Shiotani M |
332 - 338 |
A model for the van der Waals bond Magnasco V |
339 - 344 |
Two-photon spectroscopy of aligned acetaldehyde Kim Y, Meyer H |
345 - 351 |
Change of molecular packing and orientation from monolayer to multilayers of hydrogenated and fluorinated carboxylates studied by in-plane X-ray diffraction together with NEXAFS spectroscopy at CK-edge Fujimori A, Sugita Y, Nakahara H, Ito E, Hara M, Matsuie N, Kanai K, Ouchi Y, Seki K |
352 - 355 |
Nature of the'dark' state in diphenylacetylene and related molecules: state switch from the linear pi pi* state to the bent pi sigma* state Zgierski MZ, Lim EC |
356 - 361 |
Role of defects on the gas sensing properties of carbon nanotubes thin films: experiment and theory Valentini L, Mercuri F, Armentano I, Cantalini C, Picozzi S, Lozzi L, Santucci S, Sgamellotti A, Kenny JM |
362 - 366 |
Spectroscopic studies of proton transfer in hydrogen bonding: adenine complexed to HCl Dkhissi A, Houben L, Adamowicz L, Maes G |
367 - 371 |
Exploring the formation of carbon-based molecules, clusters and particles by in situ detection of scattered X-ray radiation Ossler F, Larsson J |
372 - 376 |
Nanoscale array of inversely biased molecular rectifiers Jackel F, Wang Z, Watson MD, Mullen K, Rabe JP |
377 - 382 |
Inhibition effects of ethanol on the kinetics of glucose metabolism by S-cerevisiae: NMR and modelling study Ricci M, Martini S, Bonechi C, Trabalzini L, Santucci A, Rossi C |
383 - 387 |
Internal signal stochastic resonance induced by colored noise in an intracellular calcium oscillations model Li QS, Wang P |
388 - 394 |
A hybrid MP2/planewave-DFT scheme for large chemical systems: proton jumps in zeolites Tuma C, Sauer J |
395 - 399 |
Magnetic coupling interaction under different spin multiplets in neutral manganese dimer: CASPT2 theoretical investigation Wang BW, Chen ZD |
400 - 404 |
Nano-particulate CuI film formed on porous copper substrate by iodination Yang Y, Li XF, Zhao B, Chen HL, Bao XM |
405 - 409 |
Some dynamical properties of nitrogen-14 quadrupolar spin-system with non-symmetric electric field gradient tensor Rudakov TN, Mikhaltsevitch VT, Hayes PA, Chisholm WP |
410 - 414 |
Ab initio studies of MHen+(M = Be, Mg; n=1-4) complexes Bu XP, Zhong CL, Jalbout AF |
415 - 427 |
Analysis of the spin-dipole transmission mechanism for NMR spin-spin coupling constants using orbital contributions, spin polarization, and spin-dipole energy density distribution Grafenstein J, Cremer D |
428 - 432 |
The OCS center dot (HCCH)(2) van der Waals complex: ab initio predictions for the geometry and dynamics Valdes H, Sordo JA |
433 - 435 |
Positronium inhibition in naphthalene at high pressures Goworek T, Wawryszczuk J, Zaleski R |
436 - 441 |
High spectral resolution multiplex CARS spectroscopy using chirped pulses Knutsen KP, Johnson JC, Miller AE, Petersen PB, Saykally RJ |
442 - 447 |
Extended coupled-cluster approach for magnetizabilities of small molecules Manohar PU, Vaval N, Pal S |
448 - 452 |
Valence instability in a dimer of two-orbital system: possible charge separation due to'negative U' effect Tamura M, Kato R |
453 - 459 |
The structural, electronic and vibrational properties of LiOH and NaOH: an ab initio study Merawa M, Labeguerie P, Ugliengo P, Doll K, Dovesi R |
460 - 465 |
Development of an ab initio MO-MD program based on fragment MO method -an attempt to analyze the fluctuation of protein Ishimoto T, Tokiwa H, Teramae H, Nagashima U |
466 - 470 |
Indium-doped zinc oxide nanobelts Jie JS, Wang GZ, Han XH, Yu QX, Liao Y, Li GP, Hou JG |
471 - 475 |
Synchronized and intermittent oscillations observed in a sub Belousov-Zhabotinsky reactor under continuous mass flow from a main reactor Miyazaki J, Yoshioka S, Kinoshita S |
476 - 480 |
Stability of As-n [n=4, 8, 20, 28, 32, 36, 60] cage structures Baruah T, Pederson MR, Zope RR, Beltran MR |
481 - 484 |
About the topological classification of the metal-metal bond Gervasio G, Bianchi R, Marabello D |
485 - 489 |
Invariance of the cumulant expansion under 1-particle unitary transformations in reduced density matrix theory Benayoun MD, Lu AY, Mazziotti DA |
490 - 495 |
Aligned terrylene molecules in a spin-coated ultrathin crystalline film of p-terphenyl Pfab RJ, Zimmermann J, Hettich C, Gerhardt I, Renn A, Sandoghdar V |
496 - 501 |
Highly efficient and stable doped hybrid organic-inorganic materials for solid-state dye lasers Costela A, Garcia-Moreno I, Gomez C, Garcia O, Garrido L, Sastre R |
502 - 508 |
Influence of contact geometry and molecular derivatization on the interfacial interactions between gold and conjugated wires Karzazi Y, Crispin X, Kwon O, Bredas JL, Cornil J |
509 - 516 |
Time dependent DFT investigation on the two lowest B-1(u) states of the trans isomer of stilbene and stiff-stilbenes Improta R, Santoro F, Dietl C, Papastathopoulos E, Gerber G |
517 - 517 |
Photoinduced intermolecular electron transfer between Coumarin dyes and electron donating solvents in cetyltrimethylammonium bromide (CTAB) micelles: evidence for Marcus inverted region (vol 382, pg 508, 2003) Chakraborty A, Chakrabarty D, Ham P, Seth D, Sarkar N |