Author Keywords: Chemometrics; Modelling; Fitting; Polynomial analytical function; Linear regression; Experimental design 相似文献
全文获取类型
收费全文 | 1073篇 |
免费 | 41篇 |
国内免费 | 16篇 |
专业分类
化学 | 450篇 |
晶体学 | 1篇 |
力学 | 294篇 |
综合类 | 1篇 |
数学 | 66篇 |
物理学 | 318篇 |
出版年
2023年 | 4篇 |
2022年 | 22篇 |
2021年 | 13篇 |
2020年 | 25篇 |
2019年 | 18篇 |
2018年 | 20篇 |
2017年 | 36篇 |
2016年 | 48篇 |
2015年 | 49篇 |
2014年 | 38篇 |
2013年 | 48篇 |
2012年 | 56篇 |
2011年 | 64篇 |
2010年 | 56篇 |
2009年 | 76篇 |
2008年 | 76篇 |
2007年 | 84篇 |
2006年 | 60篇 |
2005年 | 47篇 |
2004年 | 51篇 |
2003年 | 35篇 |
2002年 | 15篇 |
2001年 | 30篇 |
2000年 | 20篇 |
1999年 | 15篇 |
1998年 | 21篇 |
1997年 | 18篇 |
1996年 | 8篇 |
1995年 | 12篇 |
1994年 | 12篇 |
1993年 | 8篇 |
1992年 | 10篇 |
1991年 | 5篇 |
1990年 | 10篇 |
1989年 | 4篇 |
1988年 | 4篇 |
1987年 | 2篇 |
1986年 | 3篇 |
1984年 | 2篇 |
1982年 | 2篇 |
1979年 | 1篇 |
1978年 | 1篇 |
1977年 | 1篇 |
排序方式: 共有1130条查询结果,搜索用时 15 毫秒
21.
Simultaneous optimization of separation quality and analysis time of the micellar liquid chromatography of nine chlorophenol isomers was investigated. The effect on retention of three experimental parameters was studied using multivariate analysis. The factors studied were the concentration of sodium dodecyl sulfate, propanol content and pH of the mobile phase. The experiments were performed according to the face-centred cube central composite design and the inverse form of the experimental retention times for analytes were fitted to the polynomial models. The results of the analysis of variance showed that the models obtained explain greater than 99% of the variance observed in the chromatograms. Good predictive ability of the models was verified as high values of the statistics R2 and F were obtained for the linear relationship between predicted cross-validated and experimental values of the dependent variable. The study showed that the use of Pareto-optimality method, an approach from multi-criteria decision-making, allows the selection of the best possible combinations of separation and analysis time in micellar liquid chromatography of chlorophenols. 相似文献
22.
Rudin M Mueggler T Allegrini PR Baumann D Rausch M 《Analytical and bioanalytical chemistry》2003,377(6):973-981
Modern drug development requires technologies that allow rapid translation from the preclinical to the clinical stage. It is obvious that non-invasive imaging modalities such as magnetic resonance imaging (MRI) will play a central role in this regard. This article reviews the use of structural and functional MRI readouts for characterization of central nervous system (CNS) disorders and evaluation of the efficacy of potential CNS drugs. Examples comprise dementia of Alzheimer's type, cerebral ischemia, and neuroinflammation covering both clinical and preclinical aspects. In these examples MRI has been used to obtain relevant structural information on brain atrophy, on the location and extent of ischemic brain areas, and on the number and distribution of demyelinated plaques. These structural data are complemented by readouts assessing the functional consequences associated with the pathomorphological changes. In the last decade, MRI has evolved into a standard tool for the development of CNS drugs. With regard to target-specific/molecular imaging applications MRI is limited by its inherently low sensitivity; complementary imaging modalities utilizing optical and radionuclear reporter systems will thus be required. 相似文献
23.
One of the major techniques used for the method development of ternary and quaternary high performance liquid chromatography (HPLC) systems has been to use mixture designs, often referred to as "Glajch's Triangle". This technique does not allow for the systematic and simultaneous optimization of other factors such as gradient time, pH and temperature that affect the quality of separations. An alternative approach is to use experimental designs. The condition, however, that the composition of all components of the mobile phase must total 100% presents a problem when trying to mathematically represent ranges of each mobile phase constituent of a ternary or quaternary system. A method is described here, based on spherical coordinate representations, that adheres to the constraints of the mobile phase composition and allows experimental designs, such as central composite and factorial designs, to be applied to the simultaneous optimization of the mobile phase composition. Other factors, in particular temperature and gradient time, can then be included in the design. As a result of applying these designs to the HPLC separation of phenols and corticosteroids, it was found necessary to include three-way interactions between experimental factors in the model. The significance of these interactions shows that they need to be considered in HPLC method development. 相似文献
24.
Carmen Moscoso-Pérez Purificación López-Mahía Soledad Muniategui-Lorenzo Esther Fernández-Fernández Darío Prada-Rodríguez 《Analytica chimica acta》2004,526(2):185-192
A highly sensitive and simple method, based on hydride generation and atomic fluorescence detection, has been developed for the determination of As, Bi, Sb, Se(IV) and Te(IV) in aqua regia extracts from atmospheric particulate matter samples. Atmospheric particulates matter was collected on glass fiber filters using a medium volume sampler (PM1 particulate matter). Two-level factorial designs have been used to optimise the hydride generation atomic fluorescence spectrometry (HG-AFS) procedure. The effects of several parameters affecting the hydride generation efficiency (hydrochloric acid, sodium tetrahydroborate and potassium iodide concentrations and flow rates) have been evaluated using a Plackett-Burman experimental design. In addition, parameters affecting the hydride measurement (delay, analysis and memory times) have been also investigated. The significant parameters obtained (sodium tetrahydroborate concentration, sodium tetrahydroborate flow rate and analysis time for As; hydrochloric acid concentration and sodium tetrahydroborate flow rate for Se(IV); and sodium tetrahydroborate concentration and sodium tetrahydroborate flow rate for Te(IV)) have been optimized by using 2n + star central composite design. Hydrochloric acid concentration and sodium tetrahydroborate flow rate were the significant parameters obtained for Sb and Bi determination, respectively. Using a univariate approach these parameters were optimized. The accuracy of methods have been verified by using several certified reference materials: SRM 1648 (urban particulate matter) and SRM 1649a (urban dust). Detection limits in the range of 6 × 10−3 to 0.2 ng m−3 have been achieved. The developed methods were applied to several atmospheric particulate matter samples corresponding to A Coruña city (NW Spain). 相似文献
25.
The objectives of this work was to obtain a total nitrogen concentration in milk with the Dumas method for industrial and research applications. This method was faster than the Kjheldal method (5 min against 2 h or 3 h) but less precise. A three factor experimental design was performed to optimize the instrument, a FP-2000 supplied by LECO. The first interpretation of the experimental design was disappointing and no conclusion could be done. It was not a failure of experimental design but a lack of thinking on the physical and chemical aspect of the problem. Selection and construction of composite responses based on chemical and physical consideration were the keys to optimize the Dumas method. This method is now as precise as the Kjheldal method, but considerably faster. 相似文献
26.
Gaston Bocaz-BeneventiRosa Latorre Marta FarkováJosef Havel 《Analytica chimica acta》2002,452(1):47-63
The application of the combination of experimental design (ED) and artificial neural networks (ANNs) for the quantification of overlapped peaks in capillary zone electrophoresis is described. When the total separation cannot be achieved by separation techniques, the use of ED-ANN can be a suitable approach. The unstability of EOF causes peak shift that has to be corrected in order to apply ED-ANN methods. In this work, normalization procedure of electropherograms with consequent application of ANNs for quantification purpose was developed. Both, spectra and electropherograms can be used as multivariate data. In general, both kinds of data were found to be suitable for unresolved peaks quantification by ED-ANN approach. 相似文献
27.
Carla M. Bossu Edilene C. Ferreira Fernanda S. Chaves Eveline A. Menezes Ana Rita A. Nogueira 《Microchemical Journal》2006,84(1-2):88-92
A flow injection system was proposed to evaluate the transient product of a colorimetric reaction between hydrolysable tannin and potassium iodate (KIO3) solution. The system optimization was accomplished by using statistical methods based on experimental design. Flow rate of KIO3 solution, sample volume, carrier flow rate, and reaction coil were the selected factors for evaluation. On screening step, complete factorial 24 was used and two levels for each selected factor were studied. For the optimization phase, a centered face composite design 22 + star was employed to evaluate sample volume and flow rate of KIO3 solution, which were the factors identified in the screening phase as having more influence on the absorbance signal. After optimization, the proposed system was compared with batch determination. Some characteristics, such as analytical frequency, reagent consumption and chemical residues generation presented better results by the use of the proposed system if compared with batch method. The system presented good repeatability with standard deviation lower than 3%, for n = 10, linearity (R2 = 0.9974) for tannic acid standard, analytical frequency of 15 injections h− 1 and limit of quantification of 24 mg L− 1 of tannic acid. Good results were obtained when the proposed system was applied to hydrolysable tannin determination in Stryphnodendron barbatimão, Eucalyptus citriodora and Phyllanthus niruri, samples of plants commonly used in popular medicine. 相似文献
28.
Summary A strategy for the optimisation of direct chiral separation of omeprazole and a metabolite, hydroxi-omeprazole, in reversed
phase liquid chromatography is described.
A factorial design was used, where mobile phase pH, concentration of a mobile phase modifier, ionic strength and column temperature
were tested as the variables and enantioselective retention, column efficiency and asymmetry factor as the responses.
The experimental results were evaluated with multivariate analyses, which demonstrated that the column temperature and content
of mobile phase acetonitrile were by far the most important variables. The enantiomers of omeprazole and one of its metabolites
were baseline resolved within 15 minutes. The optimised chromatographic system was used for a separation of the enantiomers
of omeprazole and its main metabolite in a patient plasma sample. 相似文献
29.
The rapid determination of protein in plant material based on spectrophotometric determination of amino acids in protein hydrolysates with trinitrobenzenesulfonic acid has been adapted to flow injection analysis. With the manifold described, a routine sampling rate of 120 samples/h is possible, though this, as well as sensitivity, can easily be varied. The method was calibrated against the Kjeldahl method and a good correlation was obtained between the two methods over a wide range of protein values for beans. 相似文献
30.
An algorithm for searching the best polynomial analytical function for describing different experimental systems is presented. It is based
1. (1)on the generation of all possible analytical functions of a given order, with a given number of terms and with a given number of independent variables, and
2. (2)on the calculation of the parameters of all selected functions using the linear regression method.
To show the ability of the program two different examples are given:
1. (1) searching the best univariate polynomial model, and
2. (2) modelling of the stability of a two-component mixture as a function of three factors.