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91.
Dalila B. M. M. Fontes Eleni Hadjiconstantinou Nicos Christofides 《Journal of Global Optimization》2006,34(1):97-125
In this paper we obtain Lower Bounds (LBs) to concave cost network flow problems. The LBs are derived from state space relaxations
of a dynamic programming formulation, which involve the use of non-injective mapping functions guaranteing a reduction on
the cardinality of the state space. The general state space relaxation procedure is extended to address problems involving
transitions that go across several stages, as is the case of network flow problems. Applications for these LBs include: estimation
of the quality of heuristic solutions; local search methods that use information of the LB solution structure to find initial
solutions to restart the search (Fontes et al., 2003, Networks, 41, 221–228); and branch-and-bound (BB) methods having as
a bounding procedure a modified version of the LB algorithm developed here, (see Fontes et al., 2005a). These LBs are iteratively
improved by penalizing, in a Lagrangian fashion, customers not exactly satisfied or by performing state space modifications.
Both the penalties and the state space are updated by using the subgradient method. Additional constraints are developed to
improve further the LBs by reducing the searchable space. The computational results provided show that very good bounds can
be obtained for concave cost network flow problems, particularly for fixed-charge problems. 相似文献
92.
93.
Dr. Xin-Ming Hu Magnus H. Rønne Prof. Dr. Steen U. Pedersen Prof. Dr. Troels Skrydstrup Prof. Dr. Kim Daasbjerg 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2017,129(23):6568-6572
In a comparative study of the electrocatalytic CO2 reduction, cobalt meso-tetraphenylporphyrin (CoTPP) is used as a model molecular catalyst under both homogeneous and heterogeneous conditions. In the former case, employing N,N-dimethylformamide as solvent, CoTPP performs poorly as an electrocatalyst giving low product selectivity in a slow reaction at a high overpotential. However, upon straightforward immobilization of CoTPP onto carbon nanotubes, a remarkable enhancement of the electrocatalytic abilities is seen with CO2 becoming selectively reduced to CO (>90 %) at a low overpotential in aqueous medium. This effect is ascribed to the particular environment created by the aqueous medium at the catalytic site of the immobilized catalyst that facilitates the adsorption and further reaction of CO2. This work highlights the significance of assessing an immobilized molecular catalyst from more than homogeneous measurements alone. 相似文献
94.
95.
Nahid Amini Ryuji Nakao Magnus Schou Christer Halldin 《Analytical and bioanalytical chemistry》2013,405(4):1303-1310
A general method is presented for the identification of radiometabolites in plasma of human and monkey subjects after administration of positron emission tomography (PET) radioligands. The radiometabolites are first produced in vitro, using liver microsomes, subsequently separated using fast radio-liquid chromatography (radio-LC), and individually collected and identified by ultra high-performance liquid chromatography/quadrupole-time of flight-mass spectrometry in MS and MSE mode. Fast radio-LC provided superior resolution compared to conventional radio-LC, resulting in separation of a greater number of metabolites. The radiometabolites produced in vivo are then compared to and identified based on the in vitro results. This approach was applied to three PET radioligands, [11C]flumazenil, [18F]FE-PE2I, and [11C]PBR28, resulting in the identification of five, two, and one radiometabolites, respectively. This procedure can easily be adopted to identify the radiometabolites produced in vivo from a variety of PET radioligands. 相似文献
96.
A novel phenomenon is observed in the dynamics of laser-prepared coherent wave packets, bound by the Coulombic 1/r potential of an ion-pair system. After exciting weakly bound (approximately 3 meV) H(+)(-) wave packets in a Stark field, and permitting them to evolve in time, control of field dissociation via adiabatic and diabatic routes is demonstrated by applying delayed pulsed-electric fields, involving a zero-field crossing. Control manifests itself through the production of ions from each pathway at a different instant in time. This phenomenon is applied to map the oscillatory behavior of an angular momentum wave packet in a heavy Rydberg system. The characteristic frequencies of the observed Stark oscillations verify predicted mass-scaling laws for heavy Rydberg systems. 相似文献
97.
A direct catalytic azidation of primary, secondary, and tertiary allylic alcohols has been developed. This new azidation reaction affords the corresponding allylic azides in high to excellent yields and regioselectivities. The reaction provides straightforward access to allylic azides that are valuable intermediates in organic synthesis, including the preparation of primary amines or 1,2,3-triazole derivatives. 相似文献
98.
Pia Hellström Anette Heijnesson-Hultén Magnus Paulsson Helena Håkansson Ulf Germgård 《Cellulose (London, England)》2014,21(3):1489-1503
A fully bleached birch kraft pulp was treated with acidic hydrogen peroxide in the presence of ferrous ions (Fenton’s reagent) and thereafter treated mechanically in a colloid mill to produce a product containing microfibrillated cellulose (MFC). The produced MFC products were chemically and morphologically characterized and compared with MFC products produced without pretreatment as well as with enzymatic hydrolysis. Fenton treatment resulted in an increase in total charge and number of carbonyl groups while the intrinsic viscosity decreased. The Fenton treated pulps were easier to process mechanically i.e. they reached a higher specific surface area at a given mechanical treatment time and the MFC produced had a stable water-fibre suspension for at least 8 weeks compared to enzymatic pretreated pulps and pulps not subjected to any pretreatment. 相似文献
99.
Magnus Frnbck Lars Eriksson Gran Widmalm 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(3):o171-o173
The water content of the title compound, C13H24O10·3H2O, creates an extensive hydrogen‐bonding pattern, with all the hydroxyl groups of the disaccharide acting as hydrogen‐bond donors and acceptors. The water molecules are arranged in columns along the crystallographic b axis and form, together with one of the hydroxyl groups, infinite hydrogen‐bonded chains. The conformation of the disaccharide is described by glycosidic torsion angles of −38 and 18°. 相似文献
100.
Fabian Dankert H. Lars Deubner Matthias Müller Magnus R. Buchner Florian Kraus Carsten von Hänisch 《无机化学与普通化学杂志》2020,646(18):1501-1507
The work describes unexpected stoichiometric C–F bond cleavage reactions of beryllium, magnesium, gallium, hafnium and thorium halides with α,α,α-trifluorotoluene. The reaction of BeBr2 / GaBr3 or MgBr2 / GaBr3 mixtures as well as neat GaI3 with α,α,α-trifluorotoluene in the presence of (OSi2Me4)2 ( I ) yields the carbenium ion containing compounds [Ph-C(O2Si2Me4)][GaX4] (X = Br: 1 , X = I/F: 2 ). Both compounds were successfully characterized and a defluorination type reaction under incorporation of a siloxy unit was observed. Compound 1 was also characterized by single-crystal X-ray diffraction analysis. The conversion of α,α,α-trifluorotoluene with BeI2, HfI4 or ThI4 turned out to be a halodefluorination-type reaction with formation of α,α,α-triiodotoluene ( 3 ). An adequate NMR spectroscopic and the X-ray crystallographic characterization of 3 were performed for the first time. 相似文献