• Title/Summary/Keyword: Spectral Library

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A study on the screening of toxic materials by HPTLC and GC/MS (HPTLC 및 GC/MS를 이용한 유해화학물질의 스크리닝에 관한 연구)

  • Park, Sung-Woo;Jang, Seong-Gil;Park, You-Sin;Lee, Jin-Hoon;Lee, Sang-Ki;You, Jae-Hoon;Kim, Dong-Hwan;Jin, Kwang-Ho;Kim, Ki-Wook;Kim, Yu-Na;Lho, Dong-Seok
    • Analytical Science and Technology
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    • v.13 no.1
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    • pp.108-120
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    • 2000
  • To perform an effective screening for toxic materials of forensic interest detected in high profile criminal case in biological and environmental samples, we tried to construct a searchable computerized database using HPTLC(High Performance Thin Layer Chromatography) and GC/MS. Retardation factor($R_f$) values and UV spectral data of HPTLC were investigated for 160 pesticides, 34 chemicals and 39 explosives of standard grade. The data were compiled in a library. We also analyzed 112 pesticides, 31 chemicals and 17 explosives and 57 volatile organic compounds(VOCs) by GC/MS. The data for RT and characteristic mass ions were also compiled in a library.

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Investigation of USGS Short-Wave Infrared Databases and Comparison with Domestic Cases - Focusing on the Availability for the Mineralogical Analyses and an Application on the Domestic Illite - (USGS 단파장 적외선 데이터베이스 분석 및 국내 사례와 비교: 광물학적 활용도 고찰 및 국내 산출 일라이트로의 적용 사례)

  • Chang Seong Kim;Raeyoon Jeong;Soon-Oh Kim;Ji-man Cha
    • Korean Journal of Mineralogy and Petrology
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    • v.36 no.4
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    • pp.259-271
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    • 2023
  • Since the short-wave infrared spectrum has a significant range of variation depending on the production environment, countries with advanced resource exploration are collecting the spectrum and building a database. Representative organizations include the USGS and CSIRO, and they are currently carrying out a project in China that can synthesize and use a large number of existing data. The USGS library provides a total of 2,457 spectra targeting not only minerals but also various materials that respond to infrared radiation. Among these, there are 1,276 mineral spectra, which are about half of the total. The spectrum title includes information, such as analysis devices (NIC4, BECK, ASDNG, etc.), purity codes (a, b, c, d, u), and measurement methods (AREF, RREF, RTGC, TRAN). Analyzed raw data are provided in ASCII and GIF format. The CSIRO library has a total of 502 spectra, of which the majority, 493, correspond to mineral spectra. The USGS library is a free, publically available resource, while the CSIRO library is bundled with TSG8 or must be purchased separately. Among these, when comparing the eight spectra whose spectral shapes can be analyzed with the spectra of domestic illite, the positions of the absorption peaks are significantly different from those of domestic illite, except for one Japanese illite. Additional research will be needed to determine the causes of such differences, and the domestically relevant databases should be established as well.

Spectral matching using Range Queries based on Pyramid-Technique in Hyperspectral Image Library (초분광 영상 라이브러리에서 피라미드 색인 기법의 영역 질의를 이용한 스펙트럴 매칭)

  • Yu, Jae-Hwan;Kim, Deok-Hwan
    • Proceedings of the Korea Contents Association Conference
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    • 2011.05a
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    • pp.83-84
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    • 2011
  • 초분광 영상은 기존의 다중분광 영상보다 많은 밴드를 통해 넓은 범위의 파장 영역에 대한 반사율을 담고 있는 고차원 데이터이다. 이와 같은 고차원 데이터를 기존의 R-Tree, X-Tree와 같은 다차원 색인 방법을 사용하게 되면 차원의 저주(Course of Dimensionality)라는 문제가 발생한다. 본 논문에서는 차원의 저주 문제를 해결하기 위해 피라미드 기법을 사용하여 초분광 영상 라이브러리의 색인을 구축하였다. 파라미드 기법은 D차원의 데이터를 2D차원의 피라미드에 사상하고, B+-트리를 이용하여 1차원적으로 색인하는 방법이다. 실험 결과 스펙트럼 매칭을 위한 영역질의 방법이 후보자 추출 시간, 데이터 접근 빈도 측면에서 순차적 접근 방법보다 좋은 성능을 나타냈다.

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Normalization and Search of the UV/VIS Spectra Measured from TLC/HPTLC (TLC/HPTLC에서 측정된 자외/가시부 스펙트럼의 표준화 및 검색)

  • Kang, Jong-Seong
    • YAKHAK HOEJI
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    • v.38 no.4
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    • pp.366-371
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    • 1994
  • To improve the identification power of TLC/HPTLC the in situ reflectance spectra obtained directly from plates with commercial scanner are used. The spectrum normalization should be carried out prior to comparing and searching the spectra from library for the identification of compounds. Because the reflectance does not obey the Lambert-Beer's law, there arise some problems in normalization. These problems could be solved to some extent by normalizing the spectra with regression methods. The spectra are manipulated with the regression function of a curve obtained from the correlation plot. When the parabola was used as the manipulating function, the spectra were identified with the accuracy of 97% and this result was better than that of conventionally used the point and area normalization method.

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A VLSI Design for Digital Pre-distortion with Pipelined CORDIC Processors

  • Park, Jong Kang;Moon, Jun Young;Kim, Kyunghoon;Yang, Youngoo;Kim, Jong Tae
    • JSTS:Journal of Semiconductor Technology and Science
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    • v.14 no.6
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    • pp.718-727
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    • 2014
  • In a wireless communications system, a predistorter is often used to compensate for the nonlinear distortions that result from operating a power amplifier near the saturation region, thereby improving system performance and increasing the spectral efficiency for the communication channels. This paper presents a new VLSI design for the polynomial digital predistorter (DPD). The proposed DPD uses a Coordinate Rotation Digital Computing (CORDIC) processor and a PD process with a fully-pipelined architecture. Due to its simple and regular structure, it can be a competitive design when compared to existing polynomial-type and approximated DPDs. Implementing a fifth-order distorter with the proposed design requires only 43,000 logic gates in a $0.35{\mu}m$ CMOS standard cell library.

Selective Data Reduction in Gas Chromatography/Infrared Spectrometry

  • Pyo, Dong Jin;Sin, Hyeon Du
    • Bulletin of the Korean Chemical Society
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    • v.22 no.5
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    • pp.488-492
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    • 2001
  • As gas chromatography/infrared spectrometry (GC/IR) becomes routinely avaliable, methods must be developed to deal with the large amount of data produced. We demonstrate computer methods that quickly search through a large data file, locating thos e spectra that display a spectral feature of interest. Based on a modified library search routine, these selective data reduction methods retrieve all or nearly all of the compounds of interest, while rejecting the vast majority of unrelated compounds. To overcome the shifting problem of IR spectra, a search method of moving the average pattern was designed. In this moving pattern search, the average pattern of a particular functional group was not held stationary, but was allowed to be moved a little bit right and left.

A study on the analysis of current status of Seonakdong River algae using hyperspectral imaging (초분광영상을 이용한 서낙동강 조류 발생현황 분석에 관한 연구)

  • Kim, Jongmin;Gwon, Yeonghwa;Park, Yelim;Kim, Dongsu;Kwon, Jae Hyun;Kim, Young Do
    • Journal of Korea Water Resources Association
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    • v.55 no.4
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    • pp.301-308
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    • 2022
  • Algae is an indispensable primary producer in the ecosystem by supplying energy to consumers in the aquatic ecosystem, and is largely divided into green algae, blue-green algae, and diatoms. In the case of blue-green algae, the water temperature rises, which occurs in the summer and overgrows, which is the main cause of the algae bloom. Recently, the change in the occurrence time and frequency of the algae bloom is increasing due to climate change. Existing algae survey methods are performed by collecting water and measuring through sensors, and time, cost and manpower are limited. In order to overcome the limitations of these existing monitoring methods, research has been conducted to perform remote monitoring using spectroscopic devices such as multispectral and hyperspectral using satellite image, UAV, etc. In this study, we tried to confirm the possibility of species classification of remote monitoring through laboratory-scale experiments through algal culture and river water collection. In order to acquire hyperspectral images, a hyperspectral sensor capable of analyzing at 400-1000 nm was used. In order to extract the spectral characteristics of the collected river water for classification of algae species, filtration was performed using a GF/C filter to prepare a sample and images were collected. Radiation correction and base removal of the collected images were performed, and spectral information for each sample was extracted and analyzed through the process of extracting spectral information of algae to identify and compare and analyze the spectral characteristics of algae, and remote sensing based on hyperspectral images in rivers and lakes. We tried to review the applicability of monitoring.

Discrimination model of cultivation area of Corni Fructus using a GC-MS-Based metabolomics approach (GC-MS 기반 대사체학 기법을 이용한 산수유의 산지판별모델)

  • Leem, Jae-Yoon
    • Analytical Science and Technology
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    • v.29 no.1
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    • pp.1-9
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    • 2016
  • It is believed that traditional Korean medicines can be managed more scientifically through the development of logical criteria to verify their region of cultivation, and that this could contribute to the advancement of the traditional herbal medicine industry. This study attempted to determine such criteria for Sansuyu. The volatile compounds were obtained from 20 samples of domestic Corni fructus (Sansuyu) and 45 samples of Chinese Sansuyu by steam distillation. The metabolites were identified in the NIST Mass Spectral Library via the obtained gas chromatography/mass spectrometer (GC/MS) data of 53 training samples. Data binning at 0.2 min intervals was performed to normalize the number of variables used in the statistical analysis. Multivariate statistical analyses, such as principle component analysis (PCA), partial least squares-discriminant analysis (PLS-DA), and orthogonal partial least squares-discriminant analysis (OPLS-DA) were performed using the SIMCA-P software package. Significant variables with a variable importance in the projection (VIP) score higher than 1.0 were obtained from OPLS-DA, and variables that resulted in a p-value of less than 0.05 through one-way ANOVA were selected to verify the marker compounds. Finally, among the 11 variables extracted, 1-ethylbutyl-hydroperoxide (9.089 min), nonadecane (20.170 min), butylated hydroxytoluene (25.319 min), 5β,7βH,10α-eudesm-11-en-1α-ol (25.921 min), 7,9-bis(2-methyl-2-propanyl)-1-oxaspiro[4.5]deca-6,9-diene-2,8-dione (34.257 min), and 2-decyldodecyl-benzene (54.717 min) were selected as markers to indicate the origin of Sansuyu. The statistical model developed was suitable for the determination of the geographical origin of Sansuyu. The cultivation areas of four Korean and eight Chinese Sansuyu samples were predicted via the established OPLS-DA model, and it was confirmed that 11 of the 12 samples were accurately classified.

The Evaluation of on Land Cover Classification using Hyperspectral Imagery (초분광 영상을 이용한 토지피복 분류 평가)

  • Lee, Geun-Sang;Lee, Kang-Cheol;Go, Sin-Young;Choi, Yun-Woong;Cho, Gi-Sung
    • Journal of Cadastre & Land InformatiX
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    • v.44 no.2
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    • pp.103-112
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    • 2014
  • The objective of this study is to suggest the possibility on land cover classification using hyperspectal imagery on area which includes lands and waters. After atmospheric correction as a preprocessing work was conducted on hyperspectral imagery acquired by airborne hyperspectral sensor CASI-1500, the effect of atmospheric correction to a few land cover class in before and after atmospheric correction was compared and analyzed. As the result of accuracy of land cover classification by highspectral imagery using reference data as airphoto and digital topographic map, maximum likelihood method represented overall accuracy as 67.0% and minimum distance method showed overall accuracy as 52.4%. Also product accuracy of land cover classification on road, dry field and green house, but that on river, forest, grassland showed low because the area of those was composed of complex object. Therefore, the study needs to select optimal band to classify specific object and to construct spectral library considering spectral characteristics of specific object.

High Spatial Resolution Satellite Image Simulation Based on 3D Data and Existing Images

  • La, Phu Hien;Jeon, Min Cheol;Eo, Yang Dam;Nguyen, Quang Minh;Lee, Mi Hee;Pyeon, Mu Wook
    • Journal of the Korean Society of Surveying, Geodesy, Photogrammetry and Cartography
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    • v.34 no.2
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    • pp.121-132
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    • 2016
  • This study proposes an approach for simulating high spatial resolution satellite images acquired under arbitrary sun-sensor geometry using existing images and 3D (three-dimensional) data. First, satellite images, having significant differences in spectral regions compared with those in the simulated image were transformed to the same spectral regions as those in simulated image by using the UPDM (Universal Pattern Decomposition Method). Simultaneously, shadows cast by buildings or high features under the new sun position were modeled. Then, pixels that changed from shadow into non-shadow areas and vice versa were simulated on the basis of existing images. Finally, buildings that were viewed under the new sensor position were modeled on the basis of open library-based 3D reconstruction program. An experiment was conducted to simulate WV-3 (WorldView-3) images acquired under two different sun-sensor geometries based on a Pleiades 1A image, an additional WV-3 image, a Landsat image, and 3D building models. The results show that the shapes of the buildings were modeled effectively, although some problems were noted in the simulation of pixels changing from shadows cast by buildings into non-shadow. Additionally, the mean reflectance of the simulated image was quite similar to that of actual images in vegetation and water areas. However, significant gaps between the mean reflectance of simulated and actual images in soil and road areas were noted, which could be attributed to differences in the moisture content.