@article {ADFM:ADFM201603294,
	title = {Photopatterned Multidimensional Fluorescent Images},
	journal = {Advanced Functional Materials},
	volume = {26},
	number = {46},
	year = {2016},
	pages = {8471{\textendash}8477},
	keywords = {counterfeit, covert, FLUORESCENCE, imaging, PHOTOCHEMISTRY},
	issn = {1616-3028},
	doi = {10.1002/adfm.201603294},
	url = {http://dx.doi.org/10.1002/adfm.201603294},
	author = {Christensen, Peter R. and Wolf, Michael O.}
}
@article {2388,
	title = {Potential new inorganic antitumour agents from combining the anticancer traditional Chinese medicine (TCM) liriodenine with metal ions, and DNA binding studies},
	journal = {Dalton Transactions},
	number = {2},
	year = {2009},
	note = {ISI Document Delivery No.: 385IHTimes Cited: 6Cited Reference Count: 68Chen, Zhen-Feng Liu, Yan-Cheng Liu, Li-Min Wang, Heng-Shan Qin, San-Hai Wang, Bo-Long Bian, He-Dong Yang, Bin Fun, Hoong-Kun Liu, Hua-Gang Liang, Hong Orvig, Chris},
	pages = {262-272},
	type = {Article},
	abstract = {Liriodenine (L), an active component of the anticancer traditional Chinese medicine (TCM), was isolated from Zanthoxylum nitidum. Its reactions with Pt(II) and Ru(II) afforded three metal complexes: cis-[PtCl2(L)] (1), cis-[PtCl2(L)(DMSO)] (2), and cis-[RuCl2(L)(DMSO)(2)]center dot 1.5H(2)O (3), the crystal structures of L, 2 and 3 were determined by single-crystal X-ray diffraction methods. These complexes were fully characterized by elemental analysis, IR spectrophotometry, H-1 and C-13 NMR spectroscopies, and ES mass spectrometry. The in vitro cytotoxicity of L and complexes 1-3 against 11 human tumour cell lines was assayed. The metal-based compounds exhibit enhanced cytotoxicity vs. free L, suggesting that these compounds display synergy in the combination of metal ions and liriodenine. The binding properties of L and its complexes 1-3 to ct-DNA were investigated through UV-vis, fluorescence, CD spectra, viscosity and agarose gels electrophoretic measurements.},
	keywords = {AFFINITY, ALKALOIDS, CISPLATIN, CYTOTOXIC ACTIVITY, DRUGS, FLUORESCENCE, IN-VITRO, PLATINUM(II) COMPLEXES, RUTHENIUM(II) COMPLEXES, TOPOISOMERASE-II},
	isbn = {1477-9226},
	url = {<Go to ISI>://000261807400006},
	author = {Chen, Z. F. and Liu, Y. C. and Liu, L. M. and Wang, H. S. and Qin, S. H. and Wang, B. L. and Bian, H. D. and Yang, B. and Fun, H. K. and Liu, H. G. and Liang, H. and Orvig, Chris}
}
@article {2623,
	title = {Stretch-bend combination polyads in the (A)over-tilde(1)A(u) state of acetylene, C2H2},
	journal = {Journal of Molecular Spectroscopy},
	volume = {256},
	number = {2},
	year = {2009},
	note = {ISI Document Delivery No.: 478PDTimes Cited: 0Cited Reference Count: 55Steeves, Adam H. Bechtel, Hans A. Merer, Anthony J. Yamakita, Nami Tsuchiya, Soji Field, Robert W.},
	month = {Aug},
	pages = {256-278},
	type = {Article},
	abstract = {Rotational analyses are reported for a number of newly-discovered vibrational levels of the SI-trans; ((A) over tilde (1)A(u)) state of C2H2. These levels are combinations where the Franck-Condon active nu(2){\textquoteright} and nu(3){\textquoteright} vibrational modes are excited together with the low-lying bending vibrations, nu(4){\textquoteright} and nu(6){\textquoteright}. The structures of the bands are complicated by strong a- and b-axis Coriolis coupling, as well as Darling-Dennison resonance for those bands that involve overtones of the bending vibrations. The most interesting result is the strong anharmonicity in the combinations of nu(3){\textquoteright} (trans bend, a(g)) and nu(6){\textquoteright} (in-plane cis bend, b(u)). This anharmonicity presumably represents the approach of the molecule to the trans-cis isomerization barrier, where ab initio results have predicted the transition state to be half-linear, corresponding to simultaneous excitation of nu(3){\textquoteright} and nu(6){\textquoteright}. The anharmonicity also causes difficulty in the least squares fitting of some of the polyads, because the simple model of Coriolis coupling and Darling-Dennison resonance starts to break down. The effective Darling-Dennison parameter, K-4466, is found to increase rapidly with excitation of nu(3){\textquoteright}, while many small centrifugal distortion terms have had to be included in the least squares fits in order to reproduce the rotational structure correctly. Fermi resonances become important where the K-structures of different polyads overlap, as happens with the 2(1)3(1)B(1) and 3(1)B(3) polyads (B = 4 or 6). The aim of this work is to establish the detailed vibrational level structure of the S-1-trans state in order to search for possible S-1-cis ((1)A(2)) levels. This work, along with results from other workers, identifies at least one K sub-level of every single vibrational level expected up to a vibrational energy of 3500 cm(-1). (C) 2009 Elsevier Inc. All rights reserved.},
	keywords = {1AU, AB-INITIO MO, acetylene, Cis-trans isomerization, DISPERSED, DOUBLE-RESONANCE SPECTROSCOPY, FLUORESCENCE, FLUORESCENCE-SPECTRUM, INTRAMOLECULAR VIBRATIONAL REDISTRIBUTION, LASER-INDUCED, PARTIAL DEPERTURBATION, POLYATOMIC-MOLECULES, ROTATION CONSTANTS, STATE, vibration-rotation analysis, X BAND SYSTEM},
	isbn = {0022-2852},
	url = {<Go to ISI>://000268599300013},
	author = {Steeves, A. H. and Bechtel, H. A. and Merer, A. J. and Yamakita, N. and Tsuchiya, S. and Field, R. W.}
}
@article {2117,
	title = {Lipid-specific binding of the calcium-dependent antibiotic daptomycin leads to changes in lipid polymorphism of model membranes},
	journal = {Chemistry and Physics of Lipids},
	volume = {154},
	number = {2},
	year = {2008},
	note = {ISI Document Delivery No.: 336MXTimes Cited: 8Cited Reference Count: 41Jung, David Powers, Jon Paul Straus, Suzana K. Hancock, Robert E. W.},
	month = {Aug},
	pages = {120-128},
	type = {Article},
	abstract = {Daptomycin is a cyclic anionic lipopeptide with an antibiotic activity that is completely dependent on the presence of calcium (as Ca2+). In a previous study [Jung et al., 2004. Chem. Biol. 11, 949-957], it was concluded that daptomycin underwent two Ca2+-dependent structural transitions, whereby the first transition was solely dependent on Ca2+, while the second transition was dependent on both Ca2+ and the presence of negatively charged lipids that allowed daptomycin to insert into and perturb bilayer membranes with acidic character. Differences in the interaction of daptomycin with acidic and neutral membranes were further investigated by spectroscopic means. The lack of quenching of intrinsic fluorescence by the water-soluble quencher, KI, confirmed the insertion of the daptomycin Trp residue into the membrane bilayer, while the kynurenine residue was inaccessible even in an aqueous environment. Differential scanning calorimetry (DSC) indicated that the binding of daptomycin to neutral bilayers occurred through a combination of electrostatic and hydrophobic interactions, while the binding of daptomycin to Mayers containing acidic lipids primarily involved electrostatic interactions. The binding of daptomycin to acidic membranes led to the induction of non-lamellar lipid phases and membrane fusion. (C) 2008 Elsevier Ireland Ltd. All rights reserved.},
	keywords = {ANTIMICROBIAL PEPTIDES, Daptomycin, DSC, FLUORESCENCE, lipopeptide, LY146032, membrane fusion, MIMETIC SYSTEMS, MODEL MEMBRANES, P-31 NMR, PHASE-TRANSITIONS, PHOSPHOLIPIDS, RESONANCE ENERGY-TRANSFER, STAPHYLOCOCCUS-AUREUS, X-RAY-DIFFRACTION},
	isbn = {0009-3084},
	url = {<Go to ISI>://000258369200006},
	author = {Jung, D. and Powers, J. P. and Straus, S. K. and Hancock, R. E. W.}
}
@article {1577,
	title = {Design of targeting ligands in medicinal inorganic chemistry},
	journal = {Chemical Society Reviews},
	volume = {35},
	number = {6},
	year = {2006},
	note = {ISI Document Delivery No.: 047UHTimes Cited: 58Cited Reference Count: 51},
	pages = {534-544},
	type = {Review},
	abstract = {This tutorial review will highlight recent advances in medicinal inorganic chemistry pertaining to the use of multifunctional ligands for enhanced effect. Ligands that adequately bind metal ions and also include specific targeting features are gaining in popularity due to their ability to enhance the efficacy of less complicated metal-based agents. Moving beyond the traditional view of ligands modifying reactivity, stabilizing specific oxidation states, and contributing to substitution inertness, we will discuss recent work involving metal complexes with multifunctional ligands that target specific tissues, membrane receptors, or endogenous molecules, including enzymes.},
	keywords = {CANCER, COMPLEXES, FLUORESCENCE, GADOLINIUM, IN-VITRO, PARACEST AGENTS, PROTEINS, RECEPTOR, therapy, TRANSPORT},
	isbn = {0306-0012},
	url = {<Go to ISI>://000237903700005},
	author = {Storr, T. and Thompson, K. H. and Orvig, Chris}
}
@article {1530,
	title = {Raman spectroscopy for tablet coating thickness quantification and coating characterization in the presence of strong fluorescent interference},
	journal = {Journal of Pharmaceutical and Biomedical Analysis},
	volume = {41},
	number = {3},
	year = {2006},
	note = {ISI Document Delivery No.: 051CCTimes Cited: 22Cited Reference Count: 27},
	month = {Jun},
	pages = {811-819},
	type = {Article},
	abstract = {We report a novel approach to the measurement of colored tablet coating thickness, which employs Raman spectroscopy with univariate and multivariate data analysis. Our results suggest that Raman sensing can serve as a viable non-invasive means to quantify tablet coating thickness in the presence of a fluorescent ingredient in the coating formulation (food colorant Alphazurine FG or D\&C Blue No. 4). This study comparatively tests the advantage of several data transformation approaches, including mean centering, standard normal variate, and Savitzky-Golay smoothed second derivative as means of improving predictive models in the presence of fluorescence. By application of the partial least squares (PLS) calibration algorithm to establish optimum covariance between transformed spectral data and measured tablet coating thicknesses, we have been able to create predictive models with calibration errors as small as 4 mu m for a training set that spans colored coating thicknesses from 50 to 151 mu m. (c) 2006 Elsevier B.V. All rights reserved.},
	keywords = {film coating, FLUORESCENCE, FORMS, INDUCED BREAKDOWN SPECTROSCOPY, near infrared spectroscopy, QUANTITATIVE-ANALYSIS, Raman spectroscopy, REFLECTANCE, SPECTRA, SPECTROMETRY},
	isbn = {0731-7085},
	url = {<Go to ISI>://000238137100019},
	author = {Romero-Torres, S. and Perez-Ramos, J. D. and Morris, K. R. and Grant, E. R.}
}
@article {897,
	title = {Accuracy and precision of manual baseline determination},
	journal = {Applied Spectroscopy},
	volume = {58},
	number = {12},
	year = {2004},
	note = {ISI Document Delivery No.: 879GJTimes Cited: 11Cited Reference Count: 17},
	month = {Dec},
	pages = {1488-1499},
	type = {Article},
	abstract = {Vibrational spectra often require baseline removal before further data analysis can be performed. Manual (i.e., user) baseline determination and removal is a common technique used to perform this operation. Currently, little data exists that details the accuracy and precision that can be expected with manual baseline removal techniques. This study addresses this current lack of data. One hundred spectra of varying signal-to-noise ratio (SNR), signal-to-baseline ratio (SBR), baseline slope, and spectral congestion were constructed and baselines were subtracted by 16 volunteers who were categorized as being either experienced or inexperienced in baseline determination. In total, 285 baseline determinations were performed. The general level of accuracy and precision that can be expected for manually determined baselines from spectra of varying SNR, SBR, baseline slope, and spectral congestion is established. Furthermore, the effects of user experience on the accuracy and precision of baseline determination is estimated. The interactions between the above factors in affecting the accuracy and precision of baseline determination is highlighted. Where possible, the functional relationships between accuracy, precision, and the given spectral characteristic are detailed. The results provide users of manual baseline determination useful guidelines in establishing limits of accuracy and precision when performing manual baseline determination, as well as highlighting conditions that confound the accuracy and precision of manual baseline determination.},
	keywords = {baseline correction, baseline determination, CHROMATOGRAPHY, FLUORESCENCE, manual baseline removal, RAMAN-SPECTROSCOPY, SPECTRA, spectral baselines, SUBTRACTION},
	isbn = {0003-7028},
	url = {<Go to ISI>://000225704100017},
	author = {Jirasek, A. and Schulze, G. and Yu, M. M. L. and Blades, M. W. and Turner, R. F. B.}
}
@article {897,
	title = {Accuracy and precision of manual baseline determination},
	journal = {Applied Spectroscopy},
	volume = {58},
	number = {12},
	year = {2004},
	note = {ISI Document Delivery No.: 879GJTimes Cited: 11Cited Reference Count: 17},
	month = {Dec},
	pages = {1488-1499},
	type = {Article},
	abstract = {Vibrational spectra often require baseline removal before further data analysis can be performed. Manual (i.e., user) baseline determination and removal is a common technique used to perform this operation. Currently, little data exists that details the accuracy and precision that can be expected with manual baseline removal techniques. This study addresses this current lack of data. One hundred spectra of varying signal-to-noise ratio (SNR), signal-to-baseline ratio (SBR), baseline slope, and spectral congestion were constructed and baselines were subtracted by 16 volunteers who were categorized as being either experienced or inexperienced in baseline determination. In total, 285 baseline determinations were performed. The general level of accuracy and precision that can be expected for manually determined baselines from spectra of varying SNR, SBR, baseline slope, and spectral congestion is established. Furthermore, the effects of user experience on the accuracy and precision of baseline determination is estimated. The interactions between the above factors in affecting the accuracy and precision of baseline determination is highlighted. Where possible, the functional relationships between accuracy, precision, and the given spectral characteristic are detailed. The results provide users of manual baseline determination useful guidelines in establishing limits of accuracy and precision when performing manual baseline determination, as well as highlighting conditions that confound the accuracy and precision of manual baseline determination.},
	keywords = {baseline correction, baseline determination, CHROMATOGRAPHY, FLUORESCENCE, manual baseline removal, RAMAN-SPECTROSCOPY, SPECTRA, spectral baselines, SUBTRACTION},
	isbn = {0003-7028},
	url = {<Go to ISI>://000225704100017},
	author = {Jirasek, A. and Schulze, G. and Yu, M. M. L. and Blades, M. W. and Turner, R. F. B.}
}
@article {949,
	title = {Electron binding energies of Si 2p and S 2p for Si- and S-containing substances by DFT calculations using the model molecules},
	journal = {Polymer Journal},
	volume = {36},
	number = {8},
	year = {2004},
	note = {ISI Document Delivery No.: 860UCTimes Cited: 2Cited Reference Count: 39},
	pages = {600-606},
	type = {Article},
	abstract = {Si 2p and S 2p core-electron binding energies (CEBE)s of Si- and S-containing molecules were calculated by deMon DFT program using Slater{\textquoteright}s transition-state (TS) concept. In the previous works, we could not obtain the calculated values to the experimental ones of third periodic 2p CEBEs for the molecules within the range of averaged absolute deviation (AAD) of 1.0eV, although the values were calculated by the unrestricted generalized transition-state (uGTS) method. Here, we were able to get the reasonable Si 2p and S 2p CEBEs of 11, and 12 gas molecules in the AAD of 0.37 and 0.46 eV, respectively from the CEBE calculations by the unrestricted generalized diffuse ionization (uGDI) method with a modification of screening constants for third periodic elements of the 2p core-hole. Furthermore, we estimated WD (work function and the other energies) values of seven Si- and S-containing polymers [(Si(CH3)(2))(n) (PDMS), (Si(CH3)(2)O)(n), (PDMSO), (Si(C6H5)CH3)(n) (PMPS), (Si(C6H5)CH3O)(n) (PPMSO), ((CH2CH2)S)(n) (PETHS), ((CH2(CH2)(4)CH2)SO2). (PHMS), ((C6H4)S)(n) (PPS)] from the differences between calculated CEBE values for the model molecules and experimental ones on the solid polymers.},
	keywords = {APPROXIMATION, CALCULATIONS, CORE, core-electron binding energy, DENSITY-FUNCTIONAL THEORY, DFT, EMISSION-SPECTRA, ESCA, FILMS, FLUORESCENCE, ION IRRADIATION, POLYMER CONVERSION, X-ray photoelectron, X-ray photoelectron spectra},
	isbn = {0032-3896},
	url = {<Go to ISI>://000224367800004},
	author = {Motozaki, W. and Otsuka, T. and Endo, K. and Chong, D. P.}
}
@article {738,
	title = {Direct determination of polycyclic aromatic hydrocarbons in solid matrices using laser desorption/laser photoionization ion trap mass spectrometry},
	journal = {Journal of the American Society for Mass Spectrometry},
	volume = {14},
	number = {6},
	year = {2003},
	note = {ISI Document Delivery No.: 684BJTimes Cited: 8Cited Reference Count: 48},
	month = {Jun},
	pages = {562-570},
	type = {Article},
	abstract = {The development and characterization of a new instrument for solid sampling which couples IR laser desorption followed by UV laser photo-ionization and analysis using an ion trap mass spectrometer has been investigated. For calibration, a new type of solid sample preparation involving activated charcoal as the solid substrate was used. This solid sample provided a steady signal for several thousand laser shots, which allowed optimization of the experimental procedure. It was found that both the IR and UV intensity and the delay between them play an important role in both the magnitude and type of signals observed. A method of gas phase accumulation with multiple laser shots was examined. Finally, this technique was demonstrated to be effective in providing direct qualitative information. for N.I.S.T. SRM 1944 river sediment sample with no sample pre-treatment. (J Am Soc Mass Spectrom 2003,14,562-570) (C) 2003 American Society for Mass Spectrometry.},
	keywords = {CONTAMINATED SOILS, ENVIRONMENT, FLUORESCENCE, GAS-CHROMATOGRAPHY, IONIZATION DETECTION, MULTIPHOTON IONIZATION, ORGANIC-SURFACE ANALYSIS, SIMULATION, SPECTROSCOPY, THERMAL-DESORPTION},
	isbn = {1044-0305},
	url = {<Go to ISI>://000183185300002},
	author = {Specht, A. A. and Blades, M. W.}
}
@article {432,
	title = {Axis-switching and coriolis coupling in the (A)over-tilde(010)-(X)over-tilde(000) transitions of DCCl and HCCl},
	journal = {Journal of Molecular Spectroscopy},
	volume = {214},
	number = {2},
	year = {2002},
	note = {ISI Document Delivery No.: 589PDTimes Cited: 22Cited Reference Count: 18},
	month = {Aug},
	pages = {216-224},
	type = {Article},
	abstract = {The rotationally resolved (A) over tilde (010)-(X) over tilde (000) spectrum of DCCl between 12 880 and 12 964 cm(-1) was measured using frequency-modulated laser absorption spectroscopy of jet-cooled and ambient temperature samples. Transitions to levels with K-a({\textquoteright}) = 0 and 1 were assigned, and their analysis leads to improved accuracy of both the ground state rotational constants of DCCl and, when combined with existing data for HCCl, the geometry of the radical. In addition to the expected perpendicular band structure, a number of parallel (Delta K-a = 0) subbands were observed. Their intensity derives from a combination of c-type Coriolis coupling and axis-switching (J. T. Hougen and J. K. G. Watson, 1965, Can. J. Pkys. 43, 298) resulting from the change in geometry between the two states. The two contributions have been calculated for the (010)-(000) band of DCCl and previously recorded data for HCCl Satisfactory agreement with experimental measurements was obtained. The Coriolis contributions are small for these transitions, but may add to or subtract from the axis-switching. For higher bending excitation in the upper state, Coriolis coupling is predicted to make larger contributions to the parallel subband intensities. (C) 2002 Elsevier Science (USA).},
	keywords = {ABSORPTION-SPECTROSCOPY, BROMOMETHYLENE, FLUORESCENCE, NEAR-INFRARED SPECTRUM},
	isbn = {0022-2852},
	url = {<Go to ISI>://000177768100014},
	author = {Lin, A. and Kobayashi, K. and Yu, H. G. and Hall, G. E. and Muckerman, J. T. and Sears, T. J. and Merer, A. J.}
}
@article {443,
	title = {Univalent salts as modifiers in micellar capillary electrophoresis},
	journal = {Electrophoresis},
	volume = {23},
	number = {12},
	year = {2002},
	note = {ISI Document Delivery No.: 573XDTimes Cited: 11Cited Reference Count: 23},
	month = {Jun},
	pages = {1912-1920},
	type = {Article},
	abstract = {The influence of three univalent salts (LiCl, and RbCl) on the separation of amino acids labelled with 3-(4-carboxybenzoyl)-quinoline-2-carboxaldehyde (CBQCA) in micellar capillary electrophoresis has been studied. Capacity factors for a series of eight CBQCA-labelled amino acids in a sodium dodecyl sulfate (SDS) micellar system containing different concentrations of salt were measured and were found to be related to both the hydrodynamic radius of the salt counter-ion (Li+, Na+, Rb+) and the relative hydrophobicity of the amino acid. Affinities of the analytes for the micelles were generally observed to decrease as the salt concentration in the background electrolyte was increased from 10 to 50 mM. This decrease in affinity was greatest in the presence of the salt counter-ion with the smallest hydrodynamic radius and is primarily due to an increased resistance to mass transfer. Furthermore, interaction of hydrophobic analytes with the micelles is greater than that of hydrophilic analytes at all salt concentrations due to the greater strength of the hydrophobic interactions and this effect is also enhanced in the presence of a smaller counter-ion. No negative effects due to Joule heating or electromigrative dispersion were observed for low to moderate concentrations of salt, which suggests that the use of simple univalent salts to modify analyte/micelle affinities can be a practical method for improving the separation of complex mixtures.},
	keywords = {amino acids, AMMONIUM-SALTS, COUNTER-ION, EFFICIENCY, ELECTROKINETIC CHROMATOGRAPHY, FLUORESCENCE, micellar capillary electrophoresis, MIGRATION BEHAVIOR, modifiers, RESOLUTION, salt, SDS, SELECTIVITY, SEPARATION},
	isbn = {0173-0835},
	url = {<Go to ISI>://000176857000019},
	author = {McLaren, D. G. and Boulat, O. and Chen, D. D. Y.}
}
@article {5046,
	title = {Aggregation studies of benzoporphyrin derivative},
	journal = {Canadian Journal of Chemistry-Revue Canadienne De Chimie},
	volume = {79},
	number = {5-6},
	year = {2001},
	note = {ISI Document Delivery No.: 456EVTimes Cited: 11Cited Reference Count: 33},
	month = {May},
	pages = {1068-1074},
	type = {Article},
	abstract = {The photophysical properties of a ring B benzoporphyrin derivative 1,3-diene dimethylester were investigated in solution (water-DMSO mixtures). At low proportions of water in DMSO, the diester obeys Beer{\textquoteright}s law at all pH values and ionic strengths investigated. For solvent systems containing more than 30\% water, the extent of deviation from Beer{\textquoteright}s law as a function of porphyrin concentration is attributed to formation of porphyrin dimers. Dimerization equilibrium constants (Kd) have been determined in different percentage of solvent mixtures, using absorption and fluorescence spectroscopies, and were found to exhibit a linear correlation between log (Kd) and the inverse of the dielectric constant (log (Kd) = 24.6 - 1060.4 x 1/epsilon (mix)). This equation permits the calculation of Kd in mixtures of water-DMSO.},
	keywords = {AGGREGATION, benzoporphyrin, BPD, DERIVATIVE, DIMERIZATION, FLUORESCENCE, PHOTODYNAMIC THERAPY, PHOTOSENSITIZERS, porphyrins, SPECTROSCOPY, therapy},
	isbn = {0008-4042},
	url = {<Go to ISI>://000170070900079},
	author = {Delmarre, D. and Hioka, N. and Boch, R. and Sternberg, E. and Dolphin, D.}
}
@article {5059,
	title = {Theoretical X-ray photoelectron and emission spectra of Si- and S-containing polymers by density-functional theory calculations using model molecules},
	journal = {Journal of Molecular Structure},
	volume = {561},
	number = {1-3},
	year = {2001},
	note = {ISI Document Delivery No.: 420KQTimes Cited: 5Cited Reference Count: 29},
	month = {Apr},
	pages = {17-28},
	type = {Article},
	abstract = {The X-ray photoelectron and emission spectra (XPS and XES) of Si- and S-containing polymers [(-Si{-CH2-}(3))(n) (PCS), (-Si(CH3)(OH)-O-)(n) (PMHSO), (-Si(C6H5)(OH)-O-)(n) (PTES), (-Si(C6H5)(OH)-O-Si(CH3)(OH)-O-)(n) (PPMHSO), (-C6H4-O-C6H4-SO2-)(n) (PES)] were simulated by the deMon density-functional theory (DFT) calculations using the model molecules. The theoretical valence photoelectron and C K alpha X-ray emission spectra showed good accordance with some experimental ones. The combined analysis of the valence XPS and C and O K alpha XES enables us to divide the observed valence electronic distribution into the individual contributions for p sigma-, p pi- and non-bonding MOs of the polymers. (C) 2001 Elsevier Science B.V. All rights reserved.},
	keywords = {APPROXIMATION, C1S SPECTRA, CK alpha XES, DFT calculations, ELECTRONIC STATES, ENERGY, FILMS, FLUORESCENCE, OLIGOMERS, POLYMERS, SPECTROSCOPY, XPS},
	isbn = {0022-2860},
	url = {<Go to ISI>://000168004500002},
	author = {Endo, K. and Shimada, S. and Ida, T. and Suhara, M. and Kurmaev, E. Z. and Moewes, A. and Chong, D. P.}
}
@article {4991,
	title = {Laser-induced phosphorescence of SO2 in solid neon: Direct observation of the (b)over-tilde(3)A(2) state in the (OSO)-O-16-O-18 molecule},
	journal = {Journal of Physical Chemistry A},
	volume = {104},
	number = {4},
	year = {2000},
	note = {ISI Document Delivery No.: 280WFTimes Cited: 13Cited Reference Count: 41},
	month = {Feb},
	pages = {771-776},
	type = {Article},
	abstract = {Laser excitation of isotopically labeled SO2 molecules in a neon matrix has allowed the measurement of dispersed phosphorescence spectra ((a) over tilde(3)B(1)-(X) over tilde(1)A(1)) in the wavelength region 387.5-526.3 nm (19 000-25 800 cm(-1)). The origin of the (a) over tilde-(X) over tilde transition lies at 25 747 cm(-1) in (OSO)-O-16-O-16, shifted 18 cm(-1) to the red from the gas phase; the three vibrational frequencies of the (X) over tilde state are nearly unperturbed in the neon matrix (1149, 520, and 1362 cm(-1)). As the zero-phonon lines are sharp and well resolved, it has been possible to monitor emission from a specific isotopomer to obtain its excitation spectrum. The excitation spectra of matrix-isolated (OSO)-O-16-O-16 and (OSO)-O-18-O-18 in the region 350.9-388.5 nm (25 740-28 500 cm(-1)) are similar to those previously observed in the gas phase, with strong perturbations affecting all vibrational levels above a(3)B(1)(110) at 27 005 cm(-1) (370 nm). Two additional groups of bands are observed for the unsymmetrical isotopomer (OSO)-O-18-O-16; they are identified as transitions to levels of the (a) over tilde(3)B(1) state with v(3) = 1 and as direct transitions to the (b) over tilde(3)A(2) state, which both become allowed in the lower symmetry. The v(3) frequency of the (a) over tilde(3)B(1) state of (OSO)-O-18-O-16 is 922 cm(-1); for the (b) over tilde(3)A(2) state, v(1) similar or equal to 791 cm(-1) and v(2) similar or equal to 315 cm(-1), while the (b) over tilde (001) level lies 26 653 cm(-1) above the (X) over tilde (000) level.},
	keywords = {ABSORPTION, BAND SYSTEM, FLUORESCENCE, INDUCED EMISSION, MATRICES, REGION, ROTATIONAL, SPECTRA, STRUCTURE, SULFUR-DIOXIDE, VIBRATIONAL STRUCTURE},
	isbn = {1089-5639},
	url = {<Go to ISI>://000085126200014},
	author = {Zen, C. C. and Chen, I. C. and Lee, Y. P. and Merer, A. J.}
}
@article {3891,
	title = {(2)Pi-(X)over-tilde(2)Sigma(+) electronic bands of titanium methylidyne, TiCH, near 725 nm wavelength},
	journal = {Journal of Molecular Spectroscopy},
	volume = {181},
	number = {1},
	year = {1997},
	note = {ISI Document Delivery No.: WA945Times Cited: 24Cited Reference Count: 27},
	month = {Jan},
	pages = {168-179},
	type = {Article},
	abstract = {Electronic bands assigned to the linear TiCH and TiCD radicals have been recorded by laser-induced fluorescence in the 610-725 nm wavelength region, following the reaction of laser-ablated Ti atoms with methane under supersonic jet-cooled molecular beam conditions. Rotational analyses of high-resolution spectra have given the ground state substitution structure X(2) Sigma(+): r(g)(C-H) = 1.085 +/- 0.002 Angstrom: r(g)(Ti-C) = 1.7277 +/- 0.0003 Angstrom. The electronic upper state appears to be a very strongly perturbed (2) Pi start, with many extra rotational and vibrational levels appearing; it has nor barn possible to make vibrational assignments, though the Omega{\textquoteright} values have been established for some of the levels. Wavelength-resolved fluorescence spectra have given two of the three ground state vibrational frequencies: TiCH: nu(2)(bend) = 578 cm(-1), nu(3)(Ti-C stretch) = 855 cm(-1) TiCD: nu(2) = 442 cm(-1), nu(3) = 815 cm(-1) Vibrationally forbidden transitions to the ground state bending fundamental appear prominently in many of these spectra, as a result of strong vibronic coupling. No evidence for nu(1)(pi) (the C-Il stretching vibration) has been found. (C) 1997 Academic Press, Inc.},
	keywords = {EXCITATION SPECTRUM, FLUORESCENCE, FREQUENCY, MONOXIDE, PERTURBATIONS, RESONANCE, SPECTROSCOPY, STATES, SYSTEM},
	isbn = {0022-2852},
	url = {<Go to ISI>://A1997WA94500020},
	author = {Barnes, M. and Merer, A. J. and Metha, G. F.}
}
@article {7266,
	title = {INTRACAVITY LASER SPECTROSCOPY OF VO - HYPERFINE PARAMETERS AND ELECTRON CONFIGURATION OF THE B4-PI STATE},
	journal = {Journal of Molecular Spectroscopy},
	volume = {153},
	number = {1-2},
	year = {1992},
	note = {ISI Document Delivery No.: HT478Times Cited: 17Cited Reference Count: 22},
	month = {May-Jun},
	pages = {32-40},
	type = {Article},
	keywords = {FLUORESCENCE, MOLECULES, SYSTEM, TRANSITION},
	isbn = {0022-2852},
	url = {<Go to ISI>://A1992HT47800004},
	author = {Huang, G. I. and Merer, A. J. and Clouthier, D. J.}
}
@article {7352,
	title = {STABILIZATION OF THE STRUCTURE OF HORSE PLASMA VITAMIN-D BINDING-PROTEIN BY DISULFIDE BONDS},
	journal = {Biochemistry and Cell Biology-Biochimie Et Biologie Cellulaire},
	volume = {70},
	number = {1},
	year = {1992},
	note = {ISI Document Delivery No.: HG742Times Cited: 1Cited Reference Count: 27},
	month = {Jan},
	pages = {10-15},
	type = {Article},
	abstract = {Vitamin D binding protein (DBP) was isolated from horse plasma in a four-step procedure that involved Affi-Gel Blue affinity chromatography, gel filtration, hydroxylapatite chromatography, and anion exchange high-pressure liquid chromatography. The yield of DBP from 80 mL of plasma was 6-7 mg. Horse plasma DBP closely resembles other plasma DBPs, being a tryptophan-free protein of M(r) 53 000. It is able to bind to and block the polymerization of monomeric actin. The secondary structure of DBP was calculated from circular dichroism measurements to be 39\% alpha-helix, 42\% beta-sheet, and 19\% random coil. Circular dichroism and fluorescence studies revealed that the disulfide bonds of DBP contribute substantial structural stabilization to the molecule with respect to thermal denaturation. The thermal stability of DBP can be used to advantage. Incorporation of a brief treatment at 70-degrees-C into the preparative scheme enables omission of one chromatographic step, without detectable alteration of the purified product.},
	keywords = {actin, circular dichroism, CIRCULAR-DICHROISM, COMPLEX, denaturation, DISULFIDE BONDS, FLUORESCENCE, GC-GLOBULIN, POLYMERIZATION, RAT, SERUM, thermal, TROPOMYOSIN, VITAMIN-D BINDING PROTEIN},
	isbn = {0829-8211},
	url = {<Go to ISI>://A1992HG74200002},
	author = {Robinson, R. C. and Burtnick, L. D.}
}
