• 제목/요약/키워드: Toxic model

검색결과 337건 처리시간 0.021초

다이옥신의 환원적 탈염화 분해 경로와 독성 변화예측을 위한 LFER 모델 (Prediction of Pathway and Toxicity on Dechlorination of PCDDs by Linear Free Energy Relationship)

  • 김지훈;장윤석
    • 대한환경공학회지
    • /
    • 제31권2호
    • /
    • pp.125-131
    • /
    • 2009
  • 영가철과 혐기성 미생물을 이용한 환원적 탈염화반응을 통한 다이옥신 처리 능력을 평가하기 위해, 자유에너지 선형관계(linear free energy relationship)를 이용하여 다이옥신의 탈염화에 의한 농도 및 독성변화 예측 모델을 최초로 정립하였다. 수용액상에 존재하는 다이옥신류의 깁스자유에너지는 기존 문헌의 열역학적 계산결과를 범밀도함수이론(density functional theory)을 이용한 계산 수준으로 보정하였으며, 보정된 깁스자유에너지와 실험을 통해 얻은 탈염화 반응속도 상수와의 선형관계를 통해 다이옥신의 탈염화 반응 256개에 대한 반응속도상수를 예측하였다. 본 모델을 통해 탈염화에 의해 변화하는 다이옥신 류 76종에 대한 시간 별 농도를 계산할 수 있다. 8염화다이옥신(Octachlorinated dibenzo-p-dioxin, OCDD)이 완전히탈염화되어 dibenzo-p-dioxin (DD)로 탈염화되기까지는 100년 이상의 반응시간이 필요하였으며, 독성등가값(toxic equivalent quantity, TEQ)의 경우 탈염화가 진행되면서 초기농도의 10배 이상까지 증가하는 것으로 밝혀졌다. 이를 통해, 다이옥신의 처리를 위해서는 좀 더 빠른 탈염화 반응속도를 갖는 다른 전자공여 시스템을 사용하거나, 환원적 탈염화-라디칼 산화와 같은 복합 연계처리가 필요함을 알 수 있다. 본 논문을 통해 제시된 예측 기법은 다이옥신뿐 아니라 다른 할로겐화 화합물의 탈염화 예측과 여러 전자공여 시스템에 대한 평가에 적용이 가능하다.

유기화합물의 승화열 예측을 위한 QSPR분석 (QSPR analysis for predicting heat of sublimation of organic compounds)

  • 박유선;이종혁;박한웅;이성광
    • 분석과학
    • /
    • 제28권3호
    • /
    • pp.187-195
    • /
    • 2015
  • 승화열은 대기 유기 오염물질의 확산에 관련된 환경적인 문제를 해결하거나, 위험한 화학 물질의 위해성을 평가하는 데에 중요한 변수이다. 하지만 실험적으로 승화열을 측정하려면 많은 시간과 비용이 소모 되며, 그 실험자체도 복잡하고 위험하다. 따라서 본 연구에서는 유기화합물의 승화열을 간단하게 예측하는 모델을 개발하기 위하여 정량적 구조-물성 상관관계 연구를 이용하였다. 군기반 전진선택방법을 적용하여 다중선형회귀방법과 서포트 벡터 머신과 같은 학습방법에 적합한 분자표현자들을 선택하도록 하였다. 개별 모델과 복합모델들은 부스트래핑 방법과 y-임의추출법에 의해 내부검증이 되었다. 외부 테스트 데이터의 예측 성능은 적용범위를 고려하므로서 개선되었다. 다중선형회귀모델에 따르면, 승화열은 분자간의 분산력, 수소결합, 정전기적 상호작용, 쌍극자-쌍극자 상호작용과 관련이 있는 것을 나타낼 수 있었다.

3D Terrain Model Application for Explosion Assessment

  • Kim, Hyung-Seok;Chang, Eun-Mi;Kim, In-Won
    • 한국지역지리학회:학술대회
    • /
    • 한국지역지리학회 2009년도 하계학술대회 발표집
    • /
    • pp.108-115
    • /
    • 2009
  • An increase in oil and gas plants caused by development of process industry have brought into the increase in use of flammable and toxic materials in the complex process under high temperature and pressure. There is always possibility of fire and explosion of dangerous chemicals, which exist as raw materials, intermediates, and finished goods whether used or stored in the industrial plants. Since there is the need of efforts on disaster damage reduction or mitigation process, we have been conducting a research to relate explosion model on the background of real 3D terrain model. By predicting the extent of damage caused by recent disasters, we will be able to improve efficiency of recovery and, sure, to take preventive measure and emergency counterplan in response to unprepared disaster. For disaster damage prediction, it is general to conduct quantitative risk assessment, using engineering model for environmentaldescription of the target area. There are different engineering models, according to type of disaster, to be used for industry disaster such as UVCE (Unconfined Vapor Cloud Explosion), BLEVE (Boiling Liquid Evaporation Vapor Explosion), Fireball and so on, among them.we estimate explosion damage through UVCE model which is used in the event of explosion of high frequency and severe damage. When flammable gas in a tank is released to the air, firing it brings about explosion, then we can assess the effect of explosion. As 3D terrain information data is utilized to predict and estimate the extent of damage for each human and material. 3D terrain data with synthetic environment (SEDRIS) gives us more accurate damage prediction for industrial disaster and this research will show appropriate prediction results.

  • PDF

APPLICATION OF 3D TERRAIN MODEL FOR INDUSTRY DISASTER ASSESSMENT

  • Kim, Hyung-Seok;Cho, Hyoung-Ki;Chang, Eun-Mi;Kim, In-Hyun;Kim, In-Won
    • 대한원격탐사학회:학술대회논문집
    • /
    • 대한원격탐사학회 2008년도 International Symposium on Remote Sensing
    • /
    • pp.3-5
    • /
    • 2008
  • An increase in oil and gas plants caused by development of process industry have brought into the increase in use of flammable and toxic materials in the complex process under high temperature and pressure. There is always possibility of fire and explosion of dangerous chemicals, which exist as raw materials, intermediates, and finished goods whether used or stored in the industrial plants. Since there is the need of efforts on disaster damage reduction or mitigation process, we have been conducting a research to relate explosion model on the background of real 3D terrain model. By predicting the extent of damage caused by recent disasters, we will be able to improve efficiency of recovery and, sure, to take preventive measure and emergency counterplan in response to unprepared disaster. For disaster damage prediction, it is general to conduct quantitative risk assessment, using engineering model for environmental description of the target area. There are different engineering models, according to type of disaster, to be used for industry disaster such as UVCE (Unconfined Vapour Cloud Explosion), BLEVE (Boiling Liquid Evaporation Vapour Explosion), Fireball and so on, among them, we estimate explosion damage through UVCE model which is used in the event of explosion of high frequency and severe damage. When flammable gas in a tank is released to the air, firing it brings about explosion, then we can assess the effect of explosion. As 3D terrain information data is utilized to predict and estimate the extent of damage for each human and material. 3D terrain data with synthetic environment (SEDRIS) gives us more accurate damage prediction for industrial disaster and this research will show appropriate prediction results.

  • PDF

참외추출물이 스코폴라민 유도 기억상실 흰쥐의 인지능 회복에 미치는 효과 (Cognition Enhancing Effect of Muskmelon (Cucumis melo) Extracts on Scopolamine-induced Memory Impairment in Mice)

  • 박상신;박나오미;강주억;신석철;이동웅
    • 생명과학회지
    • /
    • 제19권5호
    • /
    • pp.688-691
    • /
    • 2009
  • The methanol extract of muskmelon (Cucumis melo) has been investigated for its cognition enhancing effects by evaluation of inhibitory activities on acetylcholinesterase, a degrading enzyme of acetylcholine, a brain neurotransmitter, and ${\beta}$- secretase, which forms the ${\beta}$-amyloid toxic protein from its precursor protein. A passive avoidance task, one of the animal model experiments for learning and memory, was also performed. As a result, the melon extract showed 15.8% and 35.3% inhibition on acetylcholinesterase and ${\beta}$-secretase, respectively, with a final concentration of 100 mg/ml. In the animal model test, melon extract significantly (p<0.05) lengthened the step-through latency time by 22.7% compared to the control group, suggesting that melon extract has, indeed, an effect on cognition enhancement.

플레어스택의 정량적인 복사열 분석 (Quantitative Analysis of Thermal Radiation in Flare Stack)

  • 정상용;이헌석;김범수;유진환;박철환;고재욱
    • 한국가스학회지
    • /
    • 제14권1호
    • /
    • pp.37-41
    • /
    • 2010
  • 공정내의 가연성 혹은 독성가스를 연소시켜 안전한 물질로 전환시키는 것을 목적으로 플레어시스템이 설치되어 있다. 플레어시스템은 공정의 안전성 향상을 위하여 폐가스의 안전한 연소가 가장 중요한 요소이다. 연소의 복사열이 공정의 위험요인이 되지 않도록 API 521 Code에 규정되어 있다. 플레어스택에서 발생하는 화염의 형상은 방출되는 가스의 압력과 질량유속에 의하여 jet fire의 형상을 하고 있으며, 이를 API 521 Code 방식이 아닌 Chamberlain Model을 이용하여 화염의 형상을 확인하고, 이로 인한 복사열을 분석하였다.

유해화학물질의 생태계 모델링 - I. 동경만 Nonylphenol의 환경동태 해석 - (Ecological modeling for toxic substances - I . Numerical simulation of transport and fate of Nonylphenol in Tokyo Bay-)

  • 김동명
    • 한국환경과학회지
    • /
    • 제14권9호
    • /
    • pp.827-835
    • /
    • 2005
  • A three-dimensional ecological model (EMT -3D) was applied to Nonylphenol in Tokyo Bay. EMT -3D was calibrated with data obtained in the study area. The simulated results of dissolved Nonylphenol were in good agreement with the observed values, with a correlation coefficient(R) of 0.7707 and a coefficient of determination (R2) of 0.5940. The results of sensitivity analysis showed that biodegradation rate and bioconcentration factor are most important factors for dissolved Nonylphenol and Nonylphenol in phytoplankton, respectively. In the case of Nonylphenol in particulate organic carbon, biodegradation rate and partition coefficient were important factors. Therefore, the parameters must be carefully considered in the modeling. The mass balance results showed that standing stocks of Nonylphenol in water, in particulate organic carbon and in phytoplankton are $8.60\times 10^5\;g,\;2.19\times 10^2\;g\;and\;3.78\times 10^0\;g$ respectively. With respect to the flux of dissolved Nonylphenol, biodegradation in the water column, effluent to the open sea and partition to particulate organic carbon were $6.02\times10^3\;g/day,\;6.02\times10^2\;g/day\;and\;1.02\times10^1\;g/day$, respectively.

수질관리와 수처리에의 독성시험의 응용 (An Application of Toxicity Test to Water Management and Water Treatment)

  • 김범수
    • 상하수도학회지
    • /
    • 제19권5호
    • /
    • pp.639-646
    • /
    • 2005
  • In this research, we tried to develop the application method to water management and treatment using toxicity test method. When we measure the toxicity of environmental samples, we have to decide whether we take some countermeasures to reduce the toxicity or not. The first issue is how to set these action levels in each bioassays. A new idea was attempted to authorize indirect approach of each bioassays through the response characteristics against mixture of chemicals in water quality standard. The significant response in the cell-growth-inhibition bioassay was detected for standards-mixture(STDs). For acute toxicity assay, STDs-based implicit correlation between risks to humans and bioassay data showed a rational approach to set action levels in practical management. A simple model was proposed to describe and predict the changes in the total toxicity based on the concentrations of toxic-controlling chemicals during the ozonation of landfill leachates. On the basis of this simple model, toxicity reduction was predicted for pre-aggregation treatment before ozonation and ozone concentration during the ozonation. The method proposed in this study would be useful in optimizing water treatment processes and their running conditions in terms of the toxicity reduction efficacy.

Adsorption isotherm and kinetics analysis of hexavalent chromium and mercury on mustard oil cake

  • Reddy, T. Vishnuvardhan;Chauhan, Sachin;Chakraborty, Saswati
    • Environmental Engineering Research
    • /
    • 제22권1호
    • /
    • pp.95-107
    • /
    • 2017
  • Adsorption equilibrium and kinetic behavior of two toxic heavy metals hexavalent chromium [Cr(VI)] and mercury [Hg(II)] on mustard oil cake (MOC) was studied. Isotherm of total chromium was of concave type (S1 type) suggesting cooperative adsorption. Total chromium adsorption followed BET isotherm model. Isotherm of Hg(II) was of L3 type with monolayer followed by multilayer formation due to blockage of pores of MOC at lower concentration of Hg(II). Combined BET-Langmuir and BET-Freundlich models were appropriate to predict Hg(II) adsorption data on MOC. Boyd's model confirmed that external mass transfer was rate limiting step for both total chromium and Hg(II) adsorptions with average diffusivity of $1.09{\times}10^{-16}$ and $0.97m^2/sec$, respectively. Desorption was more than 60% with Hg(II), but poor with chromium. The optimum pH for adsorptions of total chromium and Hg(II) were 2-3 and 5, respectively. At strong acidic pH, Cr(VI) was adsorbed by ion exchange mechanism and after adsorption reduced to Cr(III) and remained on MOC surface. Hg(II) removal was achieved by complexation of $HgCl_2$ with deprotonated amine ($-NH_2$) and carboxyl (COO-) groups of MOC.

BASINS/HSPF 및 WASP5를 이용한 화옹유역과 담수호의 적용성 검토 (The evaluation of BASINS/HSPF and WASP5 model in Hwaong watershed and reservoir)

  • 정광욱;윤춘경;장재호;한정윤
    • 한국농공학회:학술대회논문집
    • /
    • 한국농공학회 2005년도 학술발표논문집
    • /
    • pp.540-545
    • /
    • 2005
  • Large scale projects of sea-land reclamation have been practiced mainly to enlarge farmland in Korea. Most projects produced estuarine reservoir with dike construction, which might result in water quality problems due to block of natural flowing of stream water to the sea. Applicability of a widely accepted watershed-based water quality assessment tool (BASINS) and its associated watershed model was evaluated on the Hwaong watershed in Korea. BASINS was found to be a convenient and powerful tool for assessment of watershed characteristics, and provided various tools to delineate the watershed into land segments and river reaches, reclassify land use, and parameterize for HSPF simulation. WASP5 is a general purpose modeling system for assessing the fate and transport of conventional and toxic pollutants in surface water bodies. This study involved selection and linkage of available models to be used as a tool in evaluating the effects of BMPs for control on reservoir water quality. Overall,.Linkage of BASINS/HSPF and WASP5 was applicable and found to be a powerful tool in pollutant loading estimation from the watershed and reservoir, and its use is recommended.

  • PDF