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51.
Dr. Jérémie Topin Claire A. de March Dr. Landry Charlier Prof. Dr. Catherine Ronin Prof. Dr. Serge Antonczak Dr. Jérôme Golebiowski 《Chemistry (Weinheim an der Bergstrasse, Germany)》2014,20(33):10227-10230
A joint approach combining free‐energy calculations and calcium‐imaging assays on the broadly tuned human 1G1 olfactory receptor is reported. The free energy of binding of ten odorants was computed by means of molecular‐dynamics simulations. This state function allows separating the experimentally determined eight agonists from the two non‐agonists. This study constitutes a proof‐of‐principle for the computational deorphanization of olfactory receptors. 相似文献
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QIU Ping NI Yong-nian KOKOT Serge 《高等学校化学研究》2007,23(1):14-17
IntroductionOrganophosphorus pesticides( OPPs) are widelyused in agriculture as insecticides, but they are foundto contaminate agricultural products such as fruits andvegetables to variable extents. Because of their toxicproperties[1,2]and the potential r… 相似文献
54.
CO photodesorption from Pt(111) induced by femtosecond laser pulses is probed by IR+visible sum frequency generation (SFG). Steady state analysis of SFG spectra at varying CO pressure and laser fluence allows one to measure a approximately 5 orders of magnitude decrease of the photodesorption rate constant when CO coverage decreases from 0.37 to 0.07 monolayer. We ascribe this effect in the framework of the Menzel-Gomer-Redhead mechanism to electron delocalization in the CO layer. The lifetime of electronic excitation decreases when coverage decreases. 相似文献
55.
Excepted for the very short terms the frequency stability of ultra-stable oscillators is mainly limited by the resonator noise. In this work we proposed a parametric model of the bulk acoustic wave (BAW) resonator phase noise based on an equivalent circuit. This model explains phase noise generated by a BAW crystal from a point of view of parametric fluctuations and proves the f−1 dependences of the crystal noise. The model performance is verified with simulation. Simulation results are compared to experimental data and discussed. Comparison of three existing models is made. 相似文献
56.
Philip N Klein Serge A Plotkin Satish Rao Éva Tardos 《Journal of Algorithms in Cognition, Informatics and Logic》1997,22(2):241-269
In this paper we consider theSteiner multicutproblem. This is a generalization of the minimum multicut problem where instead of separating nodepairs, the goal is to find a minimum weight set of edges that separates all givensetsof nodes. A set is considered separated if it is not contained in a single connected component. We show anO(log3(kt)) approximation algorithm for the Steiner multicut problem, wherekis the number of sets andtis the maximum cardinality of a set. This improves theO(t log k) bound that easily follows from the previously known multicut results. We also consider an extension of multicuts to directed case, namely the problem of finding a minimum-weight set of edges whose removal ensures that none of the strongly connected components includes one of the prespecifiedknode pairs. In this paper we describe anO(log2 k) approximation algorithm for this directed multicut problem. Ifk ? n, this represents an improvement over theO(log n log log n) approximation algorithm that is implied by the technique of Seymour. 相似文献
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Liang Chen Yu Fan Jieru Qiu Dr. Régis Laurent Jin Li Prof. Dr. Jérôme Bignon Prof. Dr. Serge Mignani Prof. Dr. Anne-Marie Caminade Prof. Dr. Xiangyang Shi Prof. Dr. Jean-Pierre Majoral 《Chemistry (Weinheim an der Bergstrasse, Germany)》2020,26(26):5903-5910
First-in-class CuII and AuIII metaled phosphorus dendrons were synthesized and showed significant antiproliferative activity against several aggressive breast cancer cell lines. The data suggest that the cytotoxicity increases with reducing length of the alkyl chains, whereas the replacement of CuII with AuIII considerably increases the antiproliferative activity of metaled phosphorus dendrons. Very interestingly, we found that the cell death pathway is related to the nature of the metal complexed by the plain dendrons. CuII metaled dendrons showed a potent caspase-independent cell death pathway, whereas AuIII metaled dendrons displayed a caspase-dependent apoptotic pathway. The complexation of plain dendrons with AuIII increased the cellular lethality versus dendrons with CuII and promoted the translocation of Bax into the mitochondria and the release of Cytochrome C (Cyto C). 相似文献
59.
Benoit Roberge Serge Jandl Agung A. Nugroho Thomas T. M. Palstra Le D. Tung Geetha Balakrishnan 《Journal of Raman spectroscopy : JRS》2015,46(11):1157-1160
The coexistence at low temperature in YVO3 and LaVO3 of two competing phases with defined orbital and spin orientations is studied by Raman spectroscopy. The temperature evolution of the phonons indicates that phase coexistence, due to strain in YVO3 and fluctuations in LaVO3, is not restricted to small R ionic radius in RVO3 compounds. Also, a typical temperature at 50 K is inferred from the temperature dependence of the intensities in LaVO3. Copyright © 2015 John Wiley & Sons, Ltd. 相似文献
60.
We study sequences of empirical measures of Euler schemes associated to some non-Markovian SDEs: SDEs driven by Gaussian processes with stationary increments. We obtain the functional convergence of this sequence to a stationary solution to the SDE. Then, we end the paper by some specific properties of this stationary solution. We show that, in contrast to Markovian SDEs, its initial random value and the driving Gaussian process are always dependent. However, under an integral representation assumption, we also obtain that the past of the solution is independent of the future of the underlying innovation process of the Gaussian driving process. 相似文献