• 한국근적외분광분석학회:학술대회논문집
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• 한국근적외분광분석학회 2001년도 NIR-2001
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• pp.3114-3114
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• 2001

During the last years phytochemistry and phytopharmaceutical applications have developed rapidly and so there exists a high demand for faster and more efficient analysis techniques. Therefore we have established a near infrared transflectance spectroscopy (NIRS) method that allows a qualitative and quantitative determination of new polyphenolic pharmacological active leading compounds within a few seconds. As the NIR spectrometer has to be calibrated the compound of interest has at first to be characterized by using one or other a combination of chromatographic or electrophoretic separation techniques such as thin layer chromatography (TLC), high performance liquid chromatography (HPLC), capillary electrophoresis (CE), gas chromatography (GC) and capillary electrochromatography (CEC). Both structural elucidation and quantitative analysis of the phenolic compound is possible by direct coupling of the mentioned separation methods with a mass spectrometer (GC-MS, LC-MS/MS, CE-MS, CEC-MS) and a NMR spectrometer (LC-NMR). Furthermore the compound has to be isolated (NPLC, MPLC, prep. TLC, prep. HPLC) and its structure elucidated by spectroscopic techniques (UV, IR, HR-MS, NMR) and chemical synthesis. After that HPLC can be used to provide the reference data for the calibration step of the near infrared spectrometer. The NIRS calibration step is time consuming, which is compensated by short analysis times. After validation of the established NIRS method it is possible to determine the polyphenolic compound within seconds which allows to raise the efficiency in quality control and to reduce costs especially in the phytopharmaceutical industry.

• 한국근적외분광분석학회:학술대회논문집
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• 한국근적외분광분석학회 2001년도 NIR-2001
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• pp.1619-1619
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• 2001

Ourwork aims to assess the content of dry matter, protein, cell wall parameters and water soluble carbohydrates in forages without having to handle samples, transport them to a laboratory, dry, grind and chemically analyze them. for this purpose, the concept of fresh forage analysis under field conditions by means of compact integrated NIRS InGaAs-diode array instruments on small plot harvesters is being evaluated for plant breeding trials. This work was performed with the world first commercial experimental forage plot harvester equipped with a NIRS module for the collection, compression, and scanning of forage samples (including automatic referencing and dark current measure ments). It was used for harvesting and analyzing a number of typical forage grass and forage legume plot trials. After NIRS measurements in the field each sample was again analyzed in the laboratory by means of a conventional grating spectrometer equipped with Si-and PbS-detectors. Conventional laboratory analysis of the samples was restricted to dry matter (DM) content by means of oven drying at 105. Routine chemometric procedures were then employed to assess the comparative accuracy and precision of the DM assessments in the spectral range between 950 and 1650nm by the NIRS diode array as well as by the conventional NIRS scanning instrument. The results of this study confirmed that the type of NIRS diode array instrument employed here functioned well even in rugged field operations. further refinements proved to be necessary for optimizing the automatic filling of the sample compartment to adjust for the wide variation in forage material under conditions of extremely low or high harvest yields. The error achieved in calibrating the apparatus for forages of typical DM content proved to be satisfactory (SECV < 1.0). Possibly as a consequence of higher sampling errors, its performance in atypical forages with elevated DM contents was less satisfactory. The error level obtained on the conventional grating NIR spectrometer was similar to that of the diode array instrument for both types of forage.

• 한국광학회지
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• 제28권1호
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• pp.22-27
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• 2017

본 논문에서는 음향광학 파장선택 필터(acousto-optic tunable filter) 기반의 파장훑음 레이저(wavelength swept laser)를 이용한 시간-인코딩 근적외선 분광 기술(time-encoded near-infrared spectroscopy)을 제안하였다. 파장훑음 레이저는 800 nm 근처 영역에서 이득 스펙트럼을 가지는 반도체 광 증폭기(semiconductor optical amplifier)를 기반으로 제작되었으며, 음향광학 파장선택 필터를 공진기 내부에 삽입함으로써 음향광학 파장선택 필터에 인가되는 전기적 라디오주파수에 따라 출력 파장을 선택할 수 있도록 하였다. 본 연구에서는 종래의 기술인 백색광 분광기 기반의 검출부 분광 근적외선 분광 기술과 제안된 파장훑음 레이저 기반의 광원부 분광 근적외선 분광 기술을 각각 이용하여 근적외선 흡수 염료 샘플의 흡광도를 각기 측정하여 실험적으로 비교함으로써 본 연구에서 제안하는 음향광학 파장선택 필터 기반 파장훑음 레이저를 이용한 근적외선 분광 기술의 특성을 증명하였다.

• 한국작물학회지
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• 제57권1호
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• pp.29-34
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• 2012

The objective of this study was to rapidly evaluate fatty acids in a collection of millet (Panicum miliaceum subsp. miliaceum) of different origins so that this information could be disseminated to breeders to advance germplasm use and breeding. To develop the calibration equations for rapid and nondestructive evaluation of fatty acid content, near-infrared reflectance spectroscopy (NIRs) spectra (1104-2494 nm) of samples ground into flour ($n$=100) were obtained using a dispersive spectrometer. A modified partial least-squares model was developed to predict each component. For foxtail millet germplasm, our models returned coefficients of determination ($R^2$) of 0.89, 0.89, 0.89, and 0.92 for palmitic acid, oleic acid, linoleic acid, and total fatty acids, respectively. The prediction of the external validation set (n=10) showed significant correlation between references values and NIRs values ($r^2$=0.64, 0.90, 0.79, and 0.89 for palmitic acid, oleic acid, linoleic acid, and total fatty acids, respectively). Standard deviation/standard errors of cross-validation (SD/SECV) values were close to 3 (2.62, 2.40, 1.85, and 2.23 for palmitic acid, oleic acid, linoleic acid, and total fatty acids, respectively). These results indicate that these NIRs equations are functional for the mass screening and rapid quantification of the oleic and total fatty acids characterizing millet germplasm. Among the samples, IT153514 showed an especially high content of fatty acids ($48.14mg\;g^{-1}$), whereas IT123909 had a very low content ($34.44mg\;g^{-1}$).

• 한국육종학회지
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• 제42권5호
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• pp.448-454
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• 2010

The objective of this study was to rapidly evaluate fatty acids in a collection of foxtail millet (Setaria italica (L.) P. Beauv) of different origins so that this information could be disseminated to breeders to advance germplasm use and breeding. To develop the calibration equations for rapid and nondestructive evaluation of fatty acid content, near-infrared reflectance spectroscopy (NIRs) spectra (1104-2494 nm) of samples ground into flour (n=100) were obtained using a dispersive spectrometer. A modified partial least-squares model was developed to predict each component. For foxtail millet germplasm, our models returned coefficients of determination ($R^2$) of 0.91, 0.89, 0.98 and 0.98 for strearic acid, oleic acid, linoleic acid, and total fatty acids, respectively. The prediction of the external validation set (n=10) showed significant correlation between references values and NIRs values ($r^2=0.97$, 0.91, 0.99 for oleic, linoleic, and total fatty acids, respectively). Standard deviation/standard error of cross-validation (SD/SECV) values were greater than 3 (3.11, 5.45, and 7.50 for oleic, linoleic, and total fatty acids, respectively). These results indicate that these NIRs equations are functional for the mass screening and rapid quantification of the oleic, linolenic, and total fatty acids characterizing foxtail millet germplasm. Among the samples, IT153491 showed an especially high content of fatty acids ($84.06mg\;g^{-1}$), whereas IT188096 had a very low content ($29.92mg\;g^{-1}$).

• 고려인삼학회:학술대회논문집
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• 고려인삼학회 2002년도 학술대회지
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• pp.238-252
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• 2002

In order to screen out indicators for the discrimination of ginseng habitat, some physical and chemical characteristics of Korean red ginsengs (94 kinds) and Chinese red ginsengs (50 kinds) were analyzed by using a rheometer, an electronic nose system, a combined technique of solid phase micro-extraction (SPME) and gas chromatograph equipped with an electron capture detector (GC/ECD), an X-ray fluorescence spectrometer (XRF), an inductively coupled plasma mass spectrometer (ICP/MS), a near infrared spectrometer (NIRs) and high performance liquid chromatography equipped with evaporative light scattering detector (HPLC/ELSD). The results are summarized as follows: (i) The rhizome strengths of Korean red ginsengs were significantly higher than those of Chinese red ginsengs. (ii) The electronic nose patterns of Korean red ginsengs were significantly different from those of Chinese red ginsengs. (iii) Some unidentified peaks were detected not in the headspace of Korean red ginsengs but in the headspace of Chinese red ginsengs when the headspace volatiles prepared by the SPME technique were analyzed by GC/ECD. (iv) Either the content ratios of K to Ca or Mn to Fe were significantly different between Korean red ginsengs and Chinese red ginsengs. (v) The reflectance ratios of NIRs wavenumbers such as $904\;cm^{-1}\;to\;1088\;cm^{-1}$ for Korean red ginsengs were significantly different from those for Chinese red ginsengs. (vi) The content ratios of ginsenoside-Rg to ginsenoside-Re of Korean red ginsengs were significantly higher than those of Chinese red ginsengs. These results indicate that the rhizome strength, the electronic nose pattern, the occurrence of ECD-sensitive headspace volatile components, the content ratios of K to Ca and Mn to Fe, the NIRs pattern and the content ratio of ginsenoside-Rg to -Re may be indicators for the discrimination of ginseng habitat.

• 한국초지조사료학회지
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• 제31권4호
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• pp.415-422
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• 2011

본 연구는 최근 조사료의 신속한 품질평가 방법으로 근적외선 분광법의 이용성이 확대되고 있는 시점에 근적외선 분광기의 현장 적용성을 평가하기 위하여 수행되었다. 실험실용 근적외선분광기와 소형 근적외선분광기의 조사료 품질평가의 예측 정확성을 평가하기 위하여 전남지역에서 이탈리안 라이그라스 사일리지 67점을 수집하여 각각의 근적외선 분광기를 이용하여 스펙트럼을 측정한 후 사료가치의 실험실 분석값과 다변량회귀분석을 통하여 검량식을 유도하여 예측 정확성을 평가하였다. 이탈리안 라이그라스 사일리지의 수분함량에 대한 예측정확성은 실험실용 근적외선분광기와 소형근적외선분광기에서 각각 SEC = 2.50% ($R^2$=0.96), SEC = 2.83% ($R^2$=0.95)로 매우 신뢰성이 우수한 결과를 나타내었으나 사일리지의 발효품질의 주요 평가항목인 pH와 젖산함량은 실험실용 근적외선분광기의 결과가 SEC = 0.21% ($R^2$=0.82), SEC = 0.24% ($R^2$=0.83)로 소형 근적외선분광기 보다 우수한 결과를 나타내었다. 또한 ADF, NDF 및 조단백질 함량은 실험실용 근적외선분광기의 예측 정확성이 각각 SEC = 0.59% ($R^2$=0.96), SEC = 0.74% ($R^2$=0.97), SEC = 0.67% ($R^2$=0.82)로 높게 나타났다.

• 한국근적외분광분석학회:학술대회논문집
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• 한국근적외분광분석학회 2001년도 NIR-2001
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• pp.1617-1617
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• 2001

It is well known now that near infrared spectroscopy (NIRS) is a fast, no destructive, and inexpensive analytical technique that could be used to classify, identify, and authenticate a wide range of foods and food items. Therefore, the main aims of this study were to provide a new insight into the authentication of five strawberry (Fragaria x ananassa) varieties and to correlate them with geographical zones and the propagating methods used. Three weeks plants of five different strawberry varieties (F. x ananassa Duch. cv Camarosa, Seascape, Chandler, F. Chiloensis, and F. Virginiana) were cultivated in vitro first and then transferred to pots with special soil, and grown in a greenhouse at CINVESTAV, all varieties were acquired from California (USA). After 18 months, ten leaves from each variety were collected. Transmission spectra from each leave were recorded over a range of 10, 000-4, 000 cm$-^{1}$, 32 scans of each strawberry leave were collected using a resolution of 4 cm$-^{1}$ with a Paragon IdentiCheck FT-NIR System Spectrometer. Triplicates of each strawberry leave were used. All spectra were analyzed using principal component analysis (PCA) and soft independent modeling class analogy (SIMCA). The optimum number of components to be used in the regression was automatically determined by the software. Camarosa was the only variety grown from the same shoot but propagated by a different method (direct or in vitro). Five different classes (varieties) or clusters were observed among samples, however, larger inter class distances were presented by the two wildtype samples (F. Chiloensis and F. Virginiana). Camarosa direct and Camarosa in vitro displayed a small overlapping region between them. On the other hand, Seascape variety presented the smallest rejection percentage among all varieties (more similarities with the rest of the samples). Therefore, it can be concluded that the application of NIRS technique allowed the authentication of all strawberry varieties and geographical origin as well. It was also possible to form subclasses of the same materials. The results presented here demonstrate that NIRS is a very powerful and promising analytical tool since all materials were authenticated and classified based on their variety, origin, and treatment. This is of a tremendous relevance since the variety and origin of a plant material can be established even before it gives its typical fruit or flower.

• 분석과학
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• 제30권5호
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• pp.234-239
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• 2017

화재 현장에서 완전 연소하지 않은 잔류물의 성분을 규명하는 것은 화재 원인을 추적하는 중요한 단서가 된다. 화재 현장에서 많이 발견되는 플라스틱 연소 잔류물의 종류를 규명하기 위하여 폴리에틸렌 (Polyethylene, PE) 수지와 Acrylonitrile butadiene styrene (ABS) 수지의 연소 후 잔류물에 관한 연구를 진행 하였다. 콘 칼로리미터 (Cone calorimeter)를 사용하여 플라스틱 시료를 200, 300, 350, 400, $500^{\circ}C$로 각각 3분 동안 연소시킨 후 변화된 무게와 연소생성물을 얻었다. 각 온도에서 얻어진 연소생성물을 동결 건조 후 분쇄한 분말 시료를 FT-near infrared (NIR) spectrometer로 스펙트럼을 측정 하였다. 폴리에틸렌 수지 시료를 연소시켰을 때 $350^{\circ}C$까지는 무게의 변화가 없었으나 $400^{\circ}C$ 이상에서는 급격한 무게의 변화를 측정 할 수 있었다. 각 온도에서 얻어진 폴리에틸렌 수지 및 ABS 수지 시료의 FT-NIR 측정 스펙트럼을 주성분 분석(Principle component Analysis, PCA)를 통해서 연소 잔유물이 폴리에틸렌과 ABS 지임을 확인할 수 있었다. 따라서 근적외선 분광법으로 화재현장에서 발견되는 불연소 플라스틱의 종류를 신속하게 확인할 수 있었다.

• 분석과학
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• 제23권3호
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• pp.304-311
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• 2010

종이기록물의 특성을 평가하고 일반적으로 사용되는 파괴적인 방법이었다. 이를 개선하기 위하여 비파괴적인 방법인 근적외선 분광법(Near infrared spectroscopy, NIRS)을 적용하였다. 국가기록원이 보유하고 있는 종이 중에서 복사지, 봉투용지, 백상지, 신문용지, 한지 등과 1960년대~1980년대 각종 종이기록물 총 28점을 시료로 이용하였고, 종이기록물의 특성 평가항목인 열단장, 내절강도, pH, 함수율을 분석하였다. 그리고 각 시료에 대한 NIR스펙트럼을 구하여 가장 최적의 검량곡선을 작성하고, 이 검량곡선의 직선성, 스펙트럼 범위, 재현성 등을 검토하여 본 분석의 정확성을 검증하였다. 각 항목별 상관관계($R^2$)와 표준예측오차(standard error of prediction, SEP)는 열단장은 $R^2$=91.44, SEP=0.508, 내절강도 $R^2$=92.62, SEP=0.281, 함수율은 $R^2$=94.09, SEP=0.931, pH는 $R^2$=94.79, SEP= -0.0631로 양호하였다. 근적외선분광법은 종이시료를 파괴하지 않고 신속하게 특성을 평가할 수 있는 방법의 가능성을 보여주었다.