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排序方式: 共有910条查询结果,搜索用时 15 毫秒
61.
Dr. Paula Morales Dr. Gemma Navarro Marc Gómez-Autet Laura Redondo Prof. Dr. Javier Fernández-Ruiz Dr. Laura Pérez-Benito Dr. Arnau Cordomí Prof. Dr. Leonardo Pardo Prof. Dr. Rafael Franco Dr. Nadine Jagerovic 《Chemistry (Weinheim an der Bergstrasse, Germany)》2020,26(68):15839-15842
Single chemical entities with potential to simultaneously interact with two binding sites are emerging strategies in medicinal chemistry. We have designed, synthesized and functionally characterized the first bitopic ligands for the CB2 receptor. These compounds selectively target CB2 versus CB1 receptors. Their binding mode was studied by molecular dynamic simulations and site-directed mutagenesis. 相似文献
62.
63.
Daniel A. Morales 《Theoretical chemistry accounts》1997,98(2-3):65-67
We propose a mathematical model for the calculation of physical or chemical properties of infinite polymers, based on data
for structurally closely related finite molecules. The modelling is phenomenological but permits a physical interpretation
of the parameters involved in the equations.
Received: 11 June 1996 / Accepted: 5 June 1997 相似文献
64.
Photoelectrochemical Hydrogen Production in Alkaline Solutions Using Cu2O Coated with Earth‐Abundant Hydrogen Evolution Catalysts
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Carlos G. Morales‐Guio Laurent Liardet Dr. Matthew T. Mayer Dr. S. David Tilley Prof. Dr. Michael Grätzel Prof. Dr. Xile Hu 《Angewandte Chemie (International ed. in English)》2015,54(2):664-667
The splitting of water into hydrogen and oxygen molecules using sunlight is an attractive method for solar energy storage. Until now, photoelectrochemical hydrogen evolution is mostly studied in acidic solutions, in which the hydrogen evolution is more facile than in alkaline solutions. Herein, we report photoelectrochemical hydrogen production in alkaline solutions, which are more favorable than acidic solutions for the complementary oxygen evolution half‐reaction. We show for the first time that amorphous molybdenum sulfide is a highly active hydrogen evolution catalyst in basic medium. The amorphous molybdenum sulfide catalyst and a Ni–Mo catalyst are then deposited on surface‐protected cuprous oxide photocathodes to catalyze sunlight‐driven hydrogen production in 1 M KOH. The photocathodes give photocurrents of ?6.3 mA cm?2 at the reversible hydrogen evolution potential, the highest yet reported for a metal oxide photocathode using an earth‐abundant hydrogen evolution reaction catalyst. 相似文献
65.
Daniel Dufresne Jose Garrido Manuel Morales 《Methodology and Computing in Applied Probability》2009,11(3):359-383
Several authors have used Fourier inversion to compute prices of puts and calls, some using Parseval’s theorem. The expected
value of max (S – K, 0) also arises in excess-of-loss or stop-loss insurance, and we show that Fourier methods may be used to compute them. In
this paper, we take the idea of using Parseval’s theorem further: (1) formulas requiring weaker assumptions; (2) relationship
with classical inversion theorems for probability distributions; (3) formulas for payoffs which occur in insurance. Numerical
examples are provided.
相似文献
66.
67.
Frequencies of absorption band maxima for the first two electronic singlet transitions of coronene, triphenylene and 1,2,5,6-dibenzanthracene in vapor phase were calculated indirectly from solution spectral data. The calculations were based on two different models: the first one was a linear correlation between the solution absorption frequencies in nonpolar solvents and the solvent refractive indices. The accuracy of both methods was checked with anthracene and some of its derivatives: both methods gave a good agreement with the experimental values. 相似文献
68.
69.
70.
R.?Morales H.?Rubio M.?VélezEmail author J. I.?Martín J. M.?Alameda 《The European Physical Journal B - Condensed Matter and Complex Systems》2005,47(3):337-340
The role of material microstructure in the magnetic
anisotropy of real nanostructures has been studied by the comparison of the
magnetic behavior of arrays of amorphous and polycrystalline
CoxSi1-x lines. From the experimental measurements of angular
dependences of remanences parallel and perpendicular to the applied field we
determine the angular dispersion of effective local easy axis of anisotropy.
We have proved that amorphous lines have a dispersion of effective
anisotropy axis much smaller than the polycrystalline samples. As a
consequence, amorphous lines have a better defined magnetic behaviour,
pointing the interest of the fabrication of nanostructures made of amorphous
materials. 相似文献