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131.
利用G98及GAMESS从头计算程序的RHF/6-31方法,对β-榄香烯的全部振动基频作了计算,并与实测红外光谱做了对比,归属了它们的振动模式,讨论了它们的特征基频,并对理论计算的振动频率进行了标度校正。 相似文献
132.
Charlotte Duval Cécile Nouvel Jean‐Luc Six 《Journal of polymer science. Part A, Polymer chemistry》2014,52(8):1130-1138
Poly(d,l ‐lactide‐co‐glycolide) (PLGA) copolyesters are commonly used in biomedical applications. Researches were carried out on nontoxic or low‐toxic catalysts that are enough efficient to provide short polymerization times, adequate microstructure chains and similar properties than the commercial PLGA materials. In this study, PLGA were synthesized by ring‐opening copolymerization (ROP) using three different catalysts. Stannous octoate is the first catalyst we used, as it is very efficient, even its toxicity is still on debate. Two others low‐toxic catalysts [zinc lactate and bismuth subsalicylate (BiSS)] were also evaluated. The comparison of these ROP was realized in terms of kinetics and control of the polymerization. Then, the influence of the catalyst on the PLGA microstructure chains is reported. Finally, abiotic hydrolytic degradation rate is studied. Results described in this article show that BiSS is one very attractive catalyst to produce low toxic PLGA for biomedical applications. © 2014 Wiley Periodicals, Inc. J. Polym. Sci., Part A: Polym. Chem. 2014 , 52, 1130–1138 相似文献
133.
Dr. Joice Thomas Dr. Liliana Dobrzańska Prof. Luc Van Meervelt Prof. Mario Alfredo Quevedo Prof. Krzysztof Woźniak Marcin Stachowicz Prof. Mario Smet Prof. Wouter Maes Prof. Wim Dehaen 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(3):979-987
A synthetic route towards homodiselenacalix[4]arene macrocycles is presented, based on the dynamic covalent chemistry of diselenides. The calixarene inner rim is decorated with either alkoxy or tert‐butyl ester groups. Single‐crystal X‐ray analysis of two THF solvates with methoxy and ethoxy substituents reveals the high similarity of their molecular structures and alterations on the supramolecular level. In both crystal structures, solvent channels are present and differ in both shape and capacity. Furthermore, the methoxy‐substituted macrocycle undergoes a single‐crystal‐to‐single‐crystal transformation during which the molecular structure changes its conformation from 1,3‐alternate (loaded with THF/water) to 1,2‐alternate (apohost form). Molecular modelling techniques were applied to explore the conformational and energetic behaviour of the macrocycles. 相似文献
134.
The Rev. G. D. Yarnold 《Contemporary Physics》2013,54(4):267-275
This article discusses the presentation of the facts of capillarity at the level of the upper forms of schools or the first year of a university course. The usual formulae are derived consistently from energy considerations, and care is taken to justify such geometrical approximations as are unavoidable. A plea is made that the subject be taught from the beginning in terms of surface energy, so keeping in sight of physical reality. 相似文献
135.
Sabine Beernaerts Marie Gerard Philippe Debongnie Jean-Paul Barthelemy Luc Pussemier Alfred Copin 《International journal of environmental analytical chemistry》2013,93(6):469-480
A monitoring study was carried out in 1998-1999 on a medium-sized (c. 4580 km2) watershed of the Dyle (or Dijle) river in central Belgium, composed of both rural and urbanized areas. This watershed may be considered as representative of a large part of the country. Samples were taken each month from seven sites along the course of the river, plus one from its major affluent the Demer. The eight molecules monitored were the main herbicides used on the major crops in the area, plus some used in nonagricultural sectors. The concentrations found were mostly in the 0-3 μg/L range, with some peaks between 3 and 14 μg/L. The averages over all spring and summer samples analyzed ranged from 0.14 (bentazone) to 1.54 μg/L (diuron). Time and space specific patterns could be observed. 相似文献
136.
Marcela S. O. Wanderley Carla Oliveira Danyelly Bruneska Lucília Domingues José L. Lima Filho José A. Teixeira Solange I. Mussatto 《Chemical Papers》2013,67(7):682-687
Frutalin, a galactose-specific lectin used to detect specific tumour markers, is a protein with low expression level in breadfruit. In the present study, fed-batch fermentation in a stirred tank bioreactor was used as a strategy to enhance protein production by a recombinant Pichia pastoris KM71H. By using this process, the production of recombinant frutalin was 4-fold higher than the value obtained in shaker flasks batch assays. Supplementation of the fermentation medium with trace elements (Pichia trace minerals, PTM) was also evaluated in order to stimulate production of the recombinant protein. The addition of PTM to the minimum medium afforded a recombinant protein production of 13.4 mg L?1, which was 2.5-fold higher than that achieved from the culture medium without PTM supplementation. These results are significant as the development of strategies to improve the production of recombinant frutalin may broaden its application in cancer diagnosis. 相似文献
137.
Fuzzy identification of cutting acoustic emission with extended subtractive cluster analysis 总被引:1,自引:0,他引:1
This paper presents fuzzy acoustic emission identification in high precision hard turning process based on extended subtractive
cluster analysis combined with the least-square estimation method. The fuzzy identification method provides a simple way to
arrive at a definite conclusion based upon the information obtained with the difficulty in understanding the exact physics
of the machining process. The experimental results prove that the proposed method is efficient and feasible. 相似文献
138.
139.
140.
Oliver Salazar Celis Annie Cuyt Dirk Deschrijver Dries Vande Ginste Tom Dhaene Luc Knockaert 《Applied Mathematical Modelling》2013
In this paper a novel macromodeling scheme is presented to model the per unit of length (p.u.l.) parameters of uniform transmission lines. In particular, it is focused on single on-chip interconnects, because their p.u.l. parameters are influenced by the presence of semiconductor (s) and as such exhibit a strong frequency-dependency, making the modeling process harder. Starting from a set of very accurate tabulated data samples, obtained by two-dimensional electromagnetic modeling, rational models for the four p.u.l. parameters are constructed. The novelty of the approach lies in the fact that the rational models are positive by construction and that a controllable accuracy is obtained. These models can then further be used to construct multivariate models, e.g., for variability analysis. Here, the novel scheme is applied to an on-chip inverted embedded microstrip line, of which the signal integrity behavior is assessed in both the frequency and the time domain, demonstrating the applicability of the macromodels. 相似文献