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Abstract
A partial least-squares (PLS) modeling was developed for the simultaneous spectrophotometric determination of adenine (AD) and guanine (GU). The determination of these analytes is pharmacologically necessary. Multivariate calibration is used because of spectral overlapping. The calibration set contained AD and GU in the concentration range of 1.4–20.3 and 1.5–25.7 μg cm−3, respectively. The absorption spectra were recorded from 200 to 300 nm. The predicted residual error sum-of-squares for AD and GU was 0.0500 and 0.4000 for number of principal components 3 and 2, respectively. The root mean square error of prediction for AD and GU was 0.0913 and 0.2582, respectively. The limits of detection were 0.02 and 0.03 μg cm−3 for AD and GU, respectively. The proposed method allows the simultaneous determination of AD and GU in spiked real matrixes of human urine, serum, and plasma. 相似文献3.
Saeed Shahrokhian Hamid Reza Zare-Mehrjardi Habibollah Khajehsharifi 《Journal of Solid State Electrochemistry》2009,13(10):1567-1575
A chemically modified carbon-paste electrode (CPE) is prepared by incorporating congo red (CR) immobilized on multi-walled
carbon nanotube (MWCNT). The results show that CR is effectively immobilized on the surface of MWCNT under the ultrasonic
agitation in aqueous solution and further incorporating the nafion. The prepared electrode, due to the electrostatic repulsions
between the CR and ascorbate anion, is capable to mask the response of the ascorbic acid (AA) completely and provide an effective
method for the detection of minor amounts of uric acid (UA) in the presence of high concentrations of AA. On the other hand,
an increase in the microscopic area of the electrode by addition of MWCNT together with the electrocatalytic activity caused
to a significant enhancement in the voltammetric response to UA. Optimization of the amounts of composite modifier in the
matrix of CPE is performed by cyclic and differential pulse voltammetric measurements. The modified electrode shows a linear
response to UA in the range of 1.0 × 10−7–1.0 × 10−4 M with a detection limit of 1.0 × 10−8 M. The electrode exhibits excellent accuracies for the determination of UA in the presence of high concentrations of AA (a
recovery of 97.6%). The response of the electrode toward sulfhydryl compounds such as cysteine, penicillamine, and glutathione
is not considerable. This reveals a good selectivity for the voltammetric response toward UA. The effective electrocatalytic
property, ability for masking the voltammetric responses of the other biologically reducing agents, ease of preparation, and
surface regeneration by simple polishing together with high reproducibility and stability of the responses make the modified
electrode suitable for the selective and sensitive voltammetric detection of sub-micromolar amounts of UA in clinical and
pharmaceutical preparations. 相似文献
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Genetic algorithm (GA) is a suitable method for selecting wavelengths for partial least squares (PLS) calibration of mixtures with almost identical spectra without loss of prediction capacity using the spectrophotometric method. In this study, the concentration model is based on absorption spectra in the range of 200‐320 nm for 25 different mixtures of ascorbic acid (AA) and uric acid (UA). The calibration curve was linear over the concentration range of 1‐15 and 2‐16 μg mL?1 for ascorbic acid and uric acid, respectively. The root mean square deviation (RMSD) for ascorbic acid and uric acid with GA and without GA were 0.3071 and 0.3006, 0.3971 and 0.7063, respectively. The proposed method was successfully applied to the simultaneous determination of both analytes in human serum and urine samples. 相似文献
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Habibollah Khajehsharifi Masoumeh Sadeghi Eslam Pourbasheer 《Monatshefte für Chemie / Chemical Monthly》2009,140(6):685-691
Abstract This work describes a quantitative spectroscopic method for the analysis of ternary mixtures of ceratine (CER), creatinine
(CRE), and uric acid (UA) using multivariate data models based upon ultraviolet spectroscopy. By multivariate calibration
methods, such as partial least squares regression, it is possible to obtain a model adjusted to the concentration values of
the mixtures used in the calibration range. In this study, the calibration model is based on absorption spectra in the 200–260 nm
range for 36 different mixtures of CER, CRE, and UA. The unrelated information was removed by the orthogonal signal correction
(OSC) method and the results were proved. Evaluation of the prediction errors for the prediction set reveals the OSC-treated
data give substantially lower root mean square error of prediction (RMSEP) values than original data. The RMSEP for CER, CRE,
and UA with OSC were 1.1686, 0.2195, and 0.3726, and without OSC were 1.9057, 0.3482, and 0.6164, respectively. This procedure
allows the simultaneous determination of CER, CRE, and UA in synthetic and real samples.
Graphical abstract
相似文献
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A kinetic-spectrophotometric method for the simultaneous determination of Se(IV) and Te(IV) is described. The method is based upon the catalytic effect of these cations on the reaction of toluidine blue with sulfide. Partial least squares calibration method was employed for the data manipulation and analysis. The concentrations were varied between 0.02-0.24 and 0.01-0.08 μg/ml for Se(IV) and Te(IV), respectively. Cross-validation method was used to select the optimum number of factors (NF). The root mean square errors of difference for selenium and tellurium were 1.2 and 1.7 μg/ml, respectively. Application of the method to artificial samples and several mixtures of standard solutions of Se(IV) and Te(IV) were performed and satisfactory results were obtained. 相似文献
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