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Near-infrared spectroscopy

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https://www.readbyqxmd.com/read/28231527/rapid-discrimination-and-determination-of-antibiotics-drugs-in-plastic-syringes-using-near-infrared-spectroscopy-with-chemometric-analysis-application-to-amoxicillin-and-penicillin
#1
Laetitia Minh Mai Lê, Luc Eveleigh, Ikram Hasnaoui, Patrice Prognon, Arlette Baillet-Guffroy, Eric Caudron
The aim of this study was to investigate near infrared spectroscopy (NIRS) combined to chemometric analysis to discriminate and quantify three antibiotics by direct measurement in plastic syringes.Solutions of benzylpenicillin (PENI), amoxicillin (AMOX) and amoxicillin/clavulanic acid (AMOX/CLAV) were analyzed at therapeutic concentrations in glass vials and plastic syringes with NIR spectrometer by direct measurement. Chemometric analysis using partial least squares regression and discriminative analysis was conducted to develop qualitative and quantitative calibration models...
February 14, 2017: Journal of Pharmaceutical and Biomedical Analysis
https://www.readbyqxmd.com/read/28230805/preparation-of-photoirradiation-molecular-imprinting-polymer-for-selective-separation-of-branched-cyclodextrins
#2
Haoran Fan, Jinpeng Wang, Qingran Meng, Xueming Xu, Tianming Fan, Zhengyu Jin
In the present study, photoirradiation molecularly imprinted polymer (MIP) with azobenzene was used as a functional monomer for the selective separation of the branched cyclodextrins. The functional monomer 4-methacryloyloxy azobenzene (MAA) and the molecular template 6-O-α-d-maltosyl-β-cyclodextrin (G2-β-CD) were implemented for the molecular imprinting. The core-shell structure of photoirradiation MIP was visualized by the transmission electron microscopy (TEM). With Fourier transform infrared spectroscopy (FTIR) and thermogravimetric analysis (TGA), we identified that G2-β-CD was imprinted into the polymer and removed from the MIP...
February 21, 2017: Molecules: a Journal of Synthetic Chemistry and Natural Product Chemistry
https://www.readbyqxmd.com/read/28230756/synthesis-and-structural-evaluation-of-organo-ruthenium-complexes-with-%C3%AE-diketonates
#3
Matija Uršič, Tanja Lipec, Anton Meden, Iztok Turel
Four novel ruthenium organometallic complexes: [(η⁶-p-cymene)Ru(4,4,4-trifluoro-1-(4-bromophenyl)-1,3-butanedione)Cl] (1), [(η⁶-p-cymene)Ru(4,4,4-trifluoro-1-(4-bromophenyl)-1,3-butanedione)pta]PF₆ (2), [(η⁶-p-cymene)Ru(4,4,4-trifluoro-1-(4-iodophenyl)-1,3-butanedione)Cl] (3) and [(η⁶-p-cymene)Ru(4,4,4-trifluoro-1-(4-iodophenyl)-1,3-butanedione)pta]PF₆ (4) were synthesized and characterized by elemental analysis, infrared (IR), UV-Vis, NMR and mass spectroscopy and single-crystal X-ray diffraction...
February 20, 2017: Molecules: a Journal of Synthetic Chemistry and Natural Product Chemistry
https://www.readbyqxmd.com/read/28227950/designing-and-testing-a-wearable-wireless-fnirs-patch
#4
Mohammadreza Abtahi, Gozde Cay, Manob Jyoti Saikia, Kunal Mankodiya, Mohammadreza Abtahi, Gozde Cay, Manob Jyoti Saikia, Kunal Mankodiya, Manob Jyoti Saikia, Kunal Mankodiya, Gozde Cay, Mohammadreza Abtahi
Optical brain monitoring using near infrared (NIR) light has got a lot of attention in order to study the complexity of the brain due to several advantages as oppose to other methods such as EEG, fMRI and PET. There are a few commercially available functional NIR spectroscopy (fNIRS) brain monitoring systems, but they are still non-wearable and pose difficulties in scanning the brain while the participants are in motion. In this work, we present our endeavors to design and test a low-cost, wireless fNIRS patch using NIR light sources at wavelengths of 770 and 830nm, photodetectors and a microcontroller to trigger the light sources, read photodetector's output and transfer data wirelessly (via Bluetooth) to a smart-phone...
August 2016: Conference Proceedings: Annual International Conference of the IEEE Engineering in Medicine and Biology Society
https://www.readbyqxmd.com/read/28227929/savitzky-golay-coupled-with-digital-bandpass-filtering-as-a-pre-processing-technique-in-the-quantitative-analysis-of-glucose-from-near-infrared-spectra
#5
Krishna Chaitanya Patchava, Osamah Alrezj, Mohammed Benaissa, Hatim Behairy, Krishna Chaitanya Patchava, Osamah Alrezj, Mohammed Benaissa, Hatim Behairy, Krishna Chaitanya Patchava, Mohammed Benaissa, Osamah Alrezj, Hatim Behairy
This paper proposes a novel pre-processing method based on combining bandpass with Savitzky-Golay filtering to further improve the prediction performance of the linear calibration models Principal Component Regression (PCR) and Partial Least Squares Regression (PLSR) in near infrared spectroscopy. The proposed method is compared to the highly efficient RReliefF pre-processing technique for further evaluation. The developed calibration models have been validated to predict the glucose concentration from near infrared spectra of a mixture of glucose and human serum albumin in a phosphate buffer solution...
August 2016: Conference Proceedings: Annual International Conference of the IEEE Engineering in Medicine and Biology Society
https://www.readbyqxmd.com/read/28227668/mental-stress-grading-based-on-fnirs-signals
#6
Fares Al-Shargie, Tong Boon Tang, Masashi Kiguchi, Fares Al-Shargie, Tong Boon Tang, Masashi Kiguchi, Masashi Kiguchi, Tong Boon Tang, Fares Al-Shargie
In this study, we propose functional near infrared spectroscopy (fNIRS) to objectively grade different levels of mental stress. The levels of stress were set based on the difficulty of arithmetic task, time pressure and negative feedback about peer performance. We examined the proposed approach on twelve human subjects using the Montreal Imaging Stress Task. The experiment results revealed a reduction in cortical activation at prefrontal cortex when stressed, and the differences in hemodynamic response between control condition and under stress were significant for arithmetic difficulty level one, two and three, respectively, (p = 0...
August 2016: Conference Proceedings: Annual International Conference of the IEEE Engineering in Medicine and Biology Society
https://www.readbyqxmd.com/read/28227336/assessment-of-mental-workload-by-eeg-fnirs
#7
Haleh Aghajani, Ahmet Omurtag, Haleh Aghajani, Ahmet Omurtag, Ahmet Omurtag, Haleh Aghajani
We investigated the use of a multimodal functional neuroimaging system in quantifying mental workload of healthy human volunteers. We recorded behavioral performance measures as well as electroencephalography (EEG) and functional near-infrared spectroscopy (fNIRS) simultaneously from subjects performing n-back tasks. The EEG and fNIRS signals were used in feature generation and classification offline using support vector machines. We examined the classification accuracy of three distinct systems: EEG based; fNIRS based; and Hybrid, which contained features from the first two systems as based on their interactions...
August 2016: Conference Proceedings: Annual International Conference of the IEEE Engineering in Medicine and Biology Society
https://www.readbyqxmd.com/read/28226810/decoding-movement-direction-using-phase-space-analysis-of-hemodynamic-responses-to-arm-movements-based-on-functional-near-infrared-spectroscopy
#8
Nicoladie Tam, Luca Pollonini, George Zouridakis, Nicoladie Tam, Luca Pollonini, George Zouridakis, Luca Pollonini, Nicoladie Tam, George Zouridakis
In this study we applied phase-space analysis on the hemodynamic signals recorded from the motor cortex of human subjects using functional near infrared spectroscopy (fNIRS) to decode the direction of intentional hand movements. Our goal is to develop a brain-computer-interface (BCI) based on optical imaging that can control a wheelchair. To establish the relationship between the hemodynamic response and movement direction, participants were asked to perform repetitive arm movements in two orthogonal directions (right-left and front-back) on a horizontal plane, while the time course of the oxy-hemoglobin (oxy-Hb) and deoxy-hemoglobin (deoxy-Hb) responses were recorded...
August 2016: Conference Proceedings: Annual International Conference of the IEEE Engineering in Medicine and Biology Society
https://www.readbyqxmd.com/read/28226764/analytical-approach-to-the-temporal-changes-in-nirs-signals-to-separate-hemodynamic-change-from-brain-activity
#9
K Fukuda, H Takemoto, A Ikeda, K Fukuda, H Takemoto, A Ikeda, K Fukuda, H Takemoto, A Ikeda
In brain function measurements by near-infrared spectroscopy (NIRS), we focus on the temporal changes in the oxygenated and deoxygenated hemoglobin concentrations and propose an analytical approach to the temporal changes of the hemoglobin concentrations' cross-correlation coefficient in the brain functional signals. The cross-correlation coefficient between the oxygenated and deoxygenated hemoglobin concentrations shows negative values for brain activity and positive values for hemodynamic changes. Experiments with a 16-channel functional NIRS system show that our proposed approach clarifies the interpretation of the measured NIRS signals and it can be used to estimate the influence of hemodynamic change on brain activity...
August 2016: Conference Proceedings: Annual International Conference of the IEEE Engineering in Medicine and Biology Society
https://www.readbyqxmd.com/read/28225612/exciton-absorption-spectra-by-linear-response-methods-application-to-conjugated-polymers
#10
Martin A Mosquera, Nicholas E Jackson, Thomas J Fauvell, Matthew S J Kelley, Lin X Chen, George C Schatz, Mark A Ratner
The theoretical description of the time-evolution of excitons requires, as an initial step, the calculation of their spectra, which has been inaccessible to most users due to the high computational scaling of conventional algorithms, and accuracy issues caused by common density functionals. Previously (J. Chem. Phys., 2016, 144, 204105) we developed a simple method that resolves these issues. Our scheme is based on a two-step calculation in which a linear-response TDDFT calculation is used to generate orbitals perturbed by the excitonic state, and then a second linear-response TDDFT calculation is used to determine the spectrum of excitations relative to the excitonic state...
February 22, 2017: Journal of the American Chemical Society
https://www.readbyqxmd.com/read/28224907/multi-block-data-analysis-using-comdim-for-the-evaluation-of-complex-samples-characterization-of-edible-oils
#11
Larissa Naida Rosa, Luana Caroline de Figueiredo, Elton Guntendorfer Bonafé, Aline Coqueiro, Jesuí Vergílio Visentainer, Paulo Henrique Março, Douglas N Rutledge, Patrícia Valderrama
The ComDim chemometrics method for multi-block analysis was employed to evaluate thirty-two vegetable oil samples analyzed by near infrared (NIR) and ultraviolet-visible (UV-Vis) spectroscopy, and by Gas Chromatography with flame ionization detection (GC-FID) for their fatty acids composition. This unsupervised pattern recognition method was able to extract information from the tables of results that could be presented in informative graphs showing the relationship between the samples through the scores, the predominance of information in particular tables through the saliences and the contribution of the variables in each table which were responsible for the similarities observed in the samples, through the loadings plots...
April 8, 2017: Analytica Chimica Acta
https://www.readbyqxmd.com/read/28224248/vis-nir-spectroscopy-with-moving-window-pls-method-applied-to-rapid-analysis-of-whole-blood-viscosity
#12
Jiemei Chen, Zhiwei Yin, Yi Tang, Tao Pan
A rapid analytical method of human whole blood viscosity with low, medium, and high shear rates [WBV(L), WBV(M), and WBV(H), respectively] was developed using visible and near-infrared (Vis-NIR) spectroscopy combined with a moving-window partial least squares (MW-PLS) method. Two groups of peripheral blood samples were collected for modeling and validation. Separate analytical models were established for male and female groups to avoid interference in different gender groups and improve the homogeneity and prediction accuracy...
February 21, 2017: Analytical and Bioanalytical Chemistry
https://www.readbyqxmd.com/read/28222261/enhanced-release-of-molecules-upon-uv-light-irradiation-from-photoresponsive-hydrogels-prepared-from-bifunctional-azobenzene-and-four-arm-poly-ethylene-glycol
#13
Shiva Kumar Rastogi, Hailee E Anderson, Joseph Lamas, Scott L Barrett, Travis Cantu, Stefan Zauscher, William J Brittain, Tania Betancourt
Advances in biosensors and drug delivery depend on hydrogels that respond to external stimuli. In this work we de-scribe the preparation and characterization of photoresponsive hydrogels prepared by crosslinking of di-NHS ester of azobenzoic acid and four-armed, amine-terminated poly(ethylene glycol). The porous structure and composition of the hydrogels were confirmed by scanning electron microscopy and Fourier transform infrared (FTIR) spectroscopy. The reversible photoisomerization of the azobenzene-containing hydrogel crosslinkers in the gels was confirmed by ab-sorption spectroscopy...
February 21, 2017: ACS Applied Materials & Interfaces
https://www.readbyqxmd.com/read/28220068/reduced-activity-in-the-right-inferior-frontal-gyrus-in-elderly-apoe-e4-carriers-during-a-verbal-fluency-task
#14
Andrea Katzorke, Julia B M Zeller, Laura D Müller, Martin Lauer, Thomas Polak, Andreas Reif, Jürgen Deckert, Martin J Herrmann
Apolipoprotein-E4 (APOE-E4) is a major genetic risk factor for developing Alzheimer's disease (AD). The verbal fluency task (VFT), especially the subtask category fluency, has shown to provide a good discrimination between cognitively normal controls and subjects with AD. Interestingly, APOE-E4 seems to have no effect on the behavioral performance during a VFT in healthy elderly. Thus, the purpose of the present study was to reveal possible compensation mechanisms by investigating the effect of APOE-E4 on the hemodynamic response in non-demented elderly during a VFT by using functional near-infrared spectroscopy (fNIRS)...
2017: Frontiers in Human Neuroscience
https://www.readbyqxmd.com/read/28219840/effect-of-surface-functionalisation-on-the-interaction-of-iron-oxide-nanoparticles-with-polymerase-chain-reaction
#15
Ayse Beyza Aysan, Zdeněk Knejzlík, Pavel Ulbrich, Marek Šoltys, Aleš Zadražil, František Štěpánek
The combination of nanoparticles with the polymerase chain reaction (PCR) can have benefits such as easier sample handling or higher sensitivity, but also drawbacks such as loss of colloidal stability or inhibition of the PCR. The present work systematically investigates the interaction of magnetic iron oxide nanoparticles (MIONs) with the PCR in terms of colloidal stability and potential PCR inhibition due to interaction between the PCR components and the nanoparticle surface. Several types of MIONs with and without surface functionalisation by sodium citrate, dextran and 3-aminopropyl-triethoxysilane (APTES) were prepared and characterised by Transmission Electron Microscopy (TEM), dynamic light scattering (DLS) and Fourier Transform Infrared (FT-IR) spectroscopy...
February 6, 2017: Colloids and Surfaces. B, Biointerfaces
https://www.readbyqxmd.com/read/28218851/temperature-drift-of-conformational-equilibria-of-butyl-alcohols-studied-by-near-infrared-spectroscopy-and-fully-anharmonic-dft
#16
Justyna Grabska, Krzysztof Bernard Beć, Yukihiro Ozaki, Christian W Huck
Conformational isomerism of aliphatic alcohols with respect to the internal rotation of C-O(H) group and its impact on near-infrared (NIR) spectra has been known in the literature. However, no attempt has ever been made to investigate systematically whether and how the conformational flexibility of the aliphatic chain determines the observed NIR data of aliphatic alcohols. In the present study NIR spectra of four kinds of butyl alcohols, 1-butanol, 2-butanol, iso-butanol and tert-butanol, were investigated in diluted (0...
February 20, 2017: Journal of Physical Chemistry. A
https://www.readbyqxmd.com/read/28217088/a-non-parametric-approach-to-the-overall-estimate-of-cognitive-load-using-nirs-time-series
#17
Soheil Keshmiri, Hidenobu Sumioka, Ryuji Yamazaki, Hiroshi Ishiguro
We present a non-parametric approach to prediction of the n-back n ∈ {1, 2} task as a proxy measure of mental workload using Near Infrared Spectroscopy (NIRS) data. In particular, we focus on measuring the mental workload through hemodynamic responses in the brain induced by these tasks, thereby realizing the potential that they can offer for their detection in real world scenarios (e.g., difficulty of a conversation). Our approach takes advantage of intrinsic linearity that is inherent in the components of the NIRS time series to adopt a one-step regression strategy...
2017: Frontiers in Human Neuroscience
https://www.readbyqxmd.com/read/28216906/quality-by-design-multivariate-model-for-multicomponent-quantification-in-refining-process-of-honey
#18
Xiaoying Li, Zhisheng Wu, Xin Feng, Shanshan Liu, Xiaojie Yu, Qun Ma, Yanjiang Qiao
OBJECTIVE: A method for rapid analysis of the refining process of honey was developed based on near-infrared (NIR) spectroscopy. METHODS: Partial least square calibration models were built for the four components after the selection of the optimal spectral pretreatment method and latent factors. RESULTS: The models covered the samples of different temperatures and time points, therefore the models were robust and universal. CONCLUSIONS: These results highlighted that the NIR technology could extract the information of critical process and provide essential process knowledge of the honey refining process...
January 2017: Pharmacognosy Magazine
https://www.readbyqxmd.com/read/28216342/near-infrared-monitoring-of-roller-compacted-ribbon-density-investigating-sources-of-variation-contributing-to-noisy-spectral-data
#19
Mary Ellen Crowley, Avril Hegarty, Michael A P McAuliffe, Graham E O'Mahony, Luke Kiernan, Kevin Hayes, Abina M Crean
The aim of this study was to highlight how variability in roller compacted ribbon quality can impact on NIR spectral measurement and to propose a simple method of data selection to remove erroneous spectra. The use of NIR spectroscopy for monitoring ribbon envelope density has been previously demonstrated, however to date there has been limited discussion as to how spectral data sets can contain erroneous outliers due to poor sample presentation to the NIR probes. In this study compacted ribbon of variable quality was produced from three separate blends of microcrystalline cellulose (MCC)/lactose/magnesium stearate at 8 Roll Force settings (2-16kN/cm)...
February 16, 2017: European Journal of Pharmaceutical Sciences
https://www.readbyqxmd.com/read/28214930/investigation-of-optical-neuro-monitoring-technique-for-detection-of-maintenance-and-emergence-states-during-general-anesthesia
#20
Gabriela Hernandez-Meza, Meltem Izzetoglu, Mary Osbakken, Michael Green, Hawa Abubakar, Kurtulus Izzetoglu
The American Society of Anesthesiologist recommends peripheral physiological monitoring during general anesthesia, which offers no information regarding the effects of anesthetics on the brain. Since no "gold standard" method exists for this evaluation, such a technique is needed to ensure patient comfort, procedure quality and safety. In this study we investigated functional near infrared spectroscopy (fNIRS) as possible monitor of anesthetic effects on the prefrontal cortex. Anesthetic drugs, such as sevoflurane, suppress the cerebral metabolism and alter the cerebral blood flow...
February 18, 2017: Journal of Clinical Monitoring and Computing
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