This paper describes a suite of robust logit-log optimization routines for the fitting of a linear relation to laboratory data. The microcomputer routines assign a weighting value to each data point corresponding to the relative importance of that point. This procedure ensures that the routines identify and deal with any outlying data points. The routines are designed to generate the results of both a standard, unweighted least-squares algorithm and a robust, weighted algorithm thus providing the laboratory analyst with invaluable information concerning the data and the fitted relation. The routines are thoroughly tested on "perfect" and perturbed laboratory data. 相似文献
Being able to control the spin of magnetic molecules at the single-molecule level will make it possible to develop new spin-based nanotechnologies. Gate-field effects and electron and photon excitations have been used to achieve spin switching in molecules. Here, we show that atomic doping of molecules can be used to change the molecular spin. Furthermore, a scanning tunneling microscope was used to place or remove the atomic dopant on the molecule, allowing us to change the molecular spin in a controlled way. Bis(phthalocyaninato)yttrium (YPc(2)) molecules deposited on an Au (111) surface keep their spin-1/2 magnetic moment due to the small molecule-substrate interaction. However, when Cs atoms were carefully placed onto YPc(2) molecules, the spin of the molecule vanished as shown by our conductance measurements and corroborated by the results of density functional theory calculations. 相似文献
Ion cyclotron resonance (ICR) cells provide stability and coherence of ion oscillations in crossed electric and magnetic fields over extended periods of time. Using the Fourier transform enables precise measurements of ion oscillation frequencies. These precisely measured frequencies are converted into highly accurate mass-to-charge ratios of the analyte ions by calibration procedures. In terms of resolution and mass accuracy, Fourier transform ICR mass spectrometry (FT-ICR MS) offers the highest performance of any MS technology. This is reflected in its wide range of applications. However, in the most challenging MS application, for example, imaging, enhancements in the mass accuracy of fluctuating ion fluxes are required to continue advancing the field. One approach is to shift the ion signal power into the peak corresponding to the true cyclotron frequency instead of the reduced cyclotron frequency peak. The benefits of measuring the true cyclotron frequency include increased tolerance to electric fields within the ICR cell, which enhances frequency measurement precision. As a result, many attempts to implement this mode of FT-ICR MS operation have occurred. Examples of true cyclotron frequency measurements include detection of magnetron inter-harmonics of the reduced cyclotron frequency (i.e., the sidebands), trapping field-free (i.e., screened) ICR cells, and hyperbolic ICR cells with quadrupolar ion detection. More recently, ICR cells with spatially distributed ion clouds have demonstrated attractive performance characteristics for true cyclotron frequency ion detection. Here, we review the corresponding developments in FT-ICR MS over the past 40 years. 相似文献
Given an information need and the corresponding set of documents retrieved, it is known that user assessments for such documents differ from one user to another. One frequent reason that is put forward is the discordance between text complexity and user reading fluency. We explore this relationship from three different dimensions: quantitative features, subjective-assessed difficulty, and reader/text factors. In order to evaluate quantitative features, we wondered whether it is possible to find differences between documents that are evaluated by the user and those that are ignored according to the complexity of the document. Secondly, a task related to the evaluation of the relevance of short texts is proposed. For this end, users evaluated the relevance of these short texts by answering 20 queries. Documents complexity and relevance assessments were done previously by some human experts. Then, the relationship between participants assessments, experts assessments and document complexity is studied. Finally, a third experimentation was performed under the prism of neuro-Information Retrieval: while the participants were monitored with an electroencephalogram (EEG) headset, we tried to find a correlation among EEG signal, text difficulty and the level of comprehension of texts being read during the EEG recording. In light of the results obtained, we found some weak evidence showing that users responded to queries according to text complexity and user’s reading fluency. For the second and third group of experiments, we administered a sub-test from the Woodcock Reading Mastery Test to ensure that participants had a roughly average reading fluency. Nevertheless, we think that additional variables should be studied in the future in order to achieve a sound explanation of the interaction between text complexity and user profile.
The effect of germination (G; 5 days), soaking‐cooking (SC; 6 h–20 min, 6 h–40 min, 6 h–60 min) and microwave (M; 50%, 70%, 100%) treatments on pigeon pea (PP), dolichos bean (DB) and jack bean (JB) seeds was studied. Microstructure of seeds and functional (protein solubility, water‐holding capacity, oil‐holding capacity, emulsion stability) and pasting properties of flours were determined. Germination and microwave treatments modified the protein matrix of cotyledon cells preserving the shape of the starch granule, whereas the SC treatment (6 h–60 min) affected both. The soaking‐cooking is the most influential treatment on the functional properties of PP, DB and JB flours, as increased water absorption capacity (73–96%), decreased protein solubility (>80%) and the tendency to retrogradation of amylose (69–85%) also improved emulsion stability. 相似文献
This study aimed to evaluate the antimicrobial and antibiofilm activities of two procyanidins isolated from an ethyl acetate extract of laurel wood against a selection of foodborne pathogens. The analysis of the extract by HPLC–DAD/ESI–MS allowed us to detect the presence of two procyanidins, which were selectively isolated and identified by chromatographic and spectroscopic means as cinnamtannin B‐1 ( 1 ) and procyanidin B‐2 ( 2 ). Procyanidins 1 and 2 exhibited two biological activities: inhibition of bacterial growth at high concentrations and prevention of biofilm formation at lower concentrations. Synergistic effect was also detected when both compounds were tested in combination against Listeria monocytogenes. Significant effects were also detected on disruption of preformed biofilm. The ability of procyanidins to inhibit microbial growth and biofilm formation and to synergistically work with each other may stimulate a market as natural food preservatives, and/or natural sanitisers for processing equipment where foodborne pathogens reside. 相似文献