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81.
Juan B. Arellano B. Bangar Raju† K. Razi Naqvi Tomas Gillbro‡ 《Photochemistry and photobiology》1998,68(1):84-87
Abstract— In this short communication we present the stoichiometric ratio of bacteriochlorophyll, bacteriopheophytin and carotenoids in a few photosynthetic purple bacteria complexes (whose two-dimensional or three-dimensional structures are well known) determined using the spectrum-reconstruction method (SRCM). An important conclusion of our pigment stoichiometric analysis is the evidence for the absence of the second carotenoid in the light-harvesting complex 2 (LH2). In the process, we also highlight the useful application of SRCM in determining the molar extinction coefficients of carotenoids present in LH1, LH2 or reaction centers for which these values are not known due to isolation problems and/or stability. 相似文献
82.
83.
Predictions of the “redox” and “complex” schemes for the Fe3+ catalyzed decomposition of H2O2 have been compared with published and new experimental data by numerical integratior of the appropriate complete sets of differential equations. Apparent discrepancies for the redox scheme at high Fe3+/H2O2 ratios are shown to disappear in the complete treatment, and inconsistencies of the complex scheme with both kinetic data and spectroscopic measurements are pointed out. 相似文献
84.
85.
Ajay N. Jain Thomas G. Dietterich Richard H. Lathrop David Chapman Roger E. Critchlow Jr. Barr E. Bauer Teresa A. Webster Tomas Lozano-Perez 《Journal of computer-aided molecular design》1994,8(6):635-652
Summary Building predictive models for iterative drug design in the absence of a known target protein structure is an important challenge. We present a novel technique, Compass, that removes a major obstacle to accurate prediction by automatically selecting conformations and alignments of molecules without the benefit of a characterized active site. The technique combines explicit representation of molecular shape with neural network learning methods to produce highly predictive models, even across chemically distinct classes of molecules. We apply the method to predicting human perception of musk odor and show how the resulting models can provide graphical guidance for chemical modifications. 相似文献
86.
Attempts to characterize nucleic acid-silver interactions raise questions about how the free nucleic acid bases interact with silver ions in dilute aqueous solution. Studies of ultraviolet and infrared dichroism lead to the conclusion that with silver(I) ions in dilute solution adenine forms linear polymers, whereas 1-methyladenine forms dimers. The composition and structure of the complexes are further discussed against the background of the spectroscopic results. 相似文献
87.
We present a novel Monte Carlo algorithm for N diffusing finite particles that react on collisions. Using the theory of first-passage processes and time dependent Green's functions, we break the difficult N-body problem into independent single- and two-body propagations circumventing numerous diffusion hops used in standard Monte Carlo simulations. The new algorithm is exact, extremely efficient, and applicable to many important physical situations in arbitrary integer dimensions. 相似文献
88.
Highly photoconductive properties are reported for organic-inorganic hybrid sol-gel thin film materials composed of a classical poly(vinylcarbazole)/2,4,7-trinitro-9-fluorenone (PVK/TNF) polymeric mixture, entrapped in a SiO(2) matrix, whose pores have been chemically modified by organic functional groups. The highest photosensitivity obtained, 3.4 x 10(-10) cm Omega(-1) W(-1) at E 22 V microm(-)1, at the optimum molar ratio between the active components, TNF, PVK, and SiO(2), is in the range of the highest values ever reported for any PVK/TNF-based classical photoconductive material. It is demonstrated that the PVK/TNF-based sol-gel films follow Onsager's classical charge-generation model. The analysis of the photocurrent efficiency (Phi) of PVK/TNF-based sol-gel films by such a model provides the primary quantum yield of thermalized pair formation and the initial thermalized pair distance, phi(0) = 0.12 and r(0) = 66.1 Angstrom, respectively, for the optimized sample. As a result of Onsager's analysis, a notorious improvement of the photocurrent generation process was achieved for low TNF concentrations. 相似文献
89.
This paper considers Hardy–Lieb–Thirring inequalities for higher order differential operators. A result for general fourth-order
operators on the half-line is developed, and the trace inequality
tr( (-D)2 - CHRd,2\frac1|x|4 - V(x) )-g £ Cgò\mathbbRd V(x)+g+ \fracd4 dx, g 3 1 - \frac d 4,\mathrm{tr}\left( (-\Delta)^2 - C^{\mathrm{HR}}_{d,2}\frac{1}{|x|^4} - V(x) \right)_-^{\gamma}\leq C_\gamma\int\limits_{\mathbb{R}^d} V(x)_+^{\gamma + \frac{d}{4}}\,\mathrm{d}x, \quad \gamma \geq 1 - \frac d 4, 相似文献
90.
We theoretically discuss scattering of polaritons in semiconductor microcavities by means of a microscopic model. Taking into account the composite character of excitons (formed by an electron and a hole), we analyze the relation between polarizations of incoming and outgoing polariton states under resonant excitation by linearly polarized laser beams with opposite in-plane momenta. In addition to these polarization selection rules, we investigate the nonlinear processes up to the sixth order and we show the origin of an induced anisotropy due to the excitation beams which is responsible for the operation of an optical gate based on polariton–polariton scattering in a microcavity. 相似文献
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