• 제목/요약/키워드: Molecular Transition Region

검색결과 72건 처리시간 0.03초

멀티스케일 해석을 통한 고분자 나노복합재의 계면 상 두께와 열탄성 물성 도출 (Characterization of Thickness and Thermoelastic Properties of Interphase in Polymer Nanocomposites using Multiscale Analysis)

  • 최준명;조맹효
    • 한국전산구조공학회논문집
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    • 제29권6호
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    • pp.577-582
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    • 2016
  • 본 논문에서는 나노입자가 삽입된 고분자 복합재에서 형성되는 계면 상의 정량적인 열탄성 물성을 계산과학적 접근으로 제시하였다. 균질해법이 적용된 유한요소모델과, 미시역학법에 의한 3상 복합재의 열탄성 이론, 그리고 분자동역학 전산모사법이 본 연구에 모두 적용되었고, 이를 유기적으로 연계한 멀티스케일 모델을 수립하였다. 특히, 제시한 유한요소모델과 분자동역학 기반의 나노복합재 모델로부터 각각의 인장하중에 따른 계면의 변형에너지 밀도를 도출, 이를 직접 비교하는 과정이 본 멀티스케일 해석 과정에 포함되었다. 이로써 주어진 온도 조건에 따른 나노입자 주변의 계면 상에 대한 탄성계수와 그 두께를 물리적 엄밀해로써 정량 도출할 수 있다. 이렇게 얻은 고분자 나노복합재의 연속체모델은 다시 미시역학 모델과 연계함으로써, 최종적으로는 광범위한 온도 조건에 의한 재료의 열탄성 거동 및 유리전이거동이 계면 상의 두께와 기계적 물성에 미치는 영향에 대해 분석, 평가하였다.

DNA Sequence Analysis of 1-Nitropyrene-4,5-Oxide and 1-Nitropyrene-9,10-Oxide Induced Mutations in the hprt Gene of Chinese Hamster Ovary Cells

  • Kim, Hyun-Jo;Kim, Tae-Ho;Lee, Sun-Young;Lee, Dong-Hoon;Kim, Sang-In;Pfeifer, Gerd P.;Kim, Seog K.;Lee, Chong-Soon
    • Molecules and Cells
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    • 제19권1호
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    • pp.114-123
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    • 2005
  • Nitropyrene, the predominant nitropolycyclic hydrocarbon found in diesel exhaust, is a mutagenic and tumorigenic environmental pollutant that requires metabolic activation via nitroreduction and ring oxidation. In order to determine the role of ring oxidation in the mutagenicity of 1-nitropyrene, its oxidative metabolites, 1-nitropyrene 4,5-oxide and 1-nitropyrene 9,10-oxide, were synthesized and their mutation spectra were determined in the coding region of hprt gene of CHO cells by a PCR amplification of reverse-transcribed hprt mRNA, followed by a DNA sequence analysis. A comparison of the two metabolites for mutation frequencies showed that 1-nitropyrene 9,10-oxide was 2-times higher than 1-nitropyrene 4,5-oxide. The mutation spectrum for 1-nitropyrene 4,5-oxide was base substitutions (33/49), one base deletions (11/49) and exon deletions (5/49). In the case of 1-nitropyrene 9,10-oxide, base substitutions (27/50), one base deletions (15/50), and exon deletions (8/50) were observed. Base substitutions were distributed randomly throughout the hprt gene. The majority of the base substitutions in mutant from 1-nitropyrene 4,5-oxide treated cells were $A{\rightarrow}G$ transition (15/33) and $G{\rightarrow}A$ transition (8/33). The predominant base substitution, $A{\rightarrow}G$ transition (11/27) and $G{\rightarrow}A$ transition (8/27), were also observed in mutant from 1-nitropyrene 9,10-oxide treated cells. The mutation at the site of adenine and guanine was consistent with the previous results, where the sites of DNA adduct formed by these compounds were predominant at the sites of purines. A comparison of the mutational patterns between 1-nitropyrene 4,5-oxide and 1-nitropyrene 9,10-oxide showed that there were no significant differences in the overall mutational spectrum. These results indicate that each oxidative metabolite exhibits an equal contribution to the mutagenicity of 1-nitropyrene, and ring oxidation of 1-nitropyrene is an important metabolic pathway to the formation of significant lethal DNA lesions.

The Effect of Cr Dosage on FePt Nanoparticle Formation

  • Won, C.;Keavney, D.J.;Divan, R.;Bader, S.D.
    • Journal of Magnetics
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    • 제11권4호
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    • pp.182-188
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    • 2006
  • The search for high-density recording materials has been one of most active and vigorous field in the field of magnetism. $FePt-L1_{0}$ nanoparticle has emerged as a potential candidate because of its high anisotropy. In this paper, we provide an overview of recent work at Argonne National Laboratory that contributes to the ongoing dialogue concerning the relation between structure and properties of the FePt nanoparticle system. In particular we discuss the ability to control structure and properties via dosing with Cr. Cr-dosed FePt films were grown via molecular beam epitaxy and annealed at $550^{\circ}C$ in an ultrahigh vacuum chamber, and were studied with the surface magneto-optic Kerr effect (SMOKE), scanning electron microscopy (SEM) and x-ray magnetic circular dichroism (XMCD). We found that small dosage of Cr helps to generate $L1_{0}$ phase FePt magnetic nanoparticles with small size, defined shape and regular spatial distribution on MgO (001) substrate. The nanostructures are ferromagnetic with high magnetic coercivity (${\sim}0.9T$) and magnetic easy axis in the desired out-of-plane orientation. We also show that controlling the lateral region where nanostructures exist is possible via artificial patterning with Cr.

Formation of globular clusters in cosmological radiation hydrodynamic simulation

  • Yi, Sukyoung K.;Kimm, Taysun
    • 천문학회보
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    • 제41권2호
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    • pp.36.1-36.1
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    • 2016
  • This is a presentation of the paper published as Kimm et al. 2016, ApJ, 823, 52. We investigate the formation of metal-poor globular clusters (GCs) at the center of two dark matter halos with $Mhalo{\sim}4{\times}107Msun$ at z>10 using cosmological radiation-hydrodynamics simulations. We find that very compact (${\leq}1$ pc) and massive (${\sim}6{\times}105Msun$) clusters form rapidly when pristine gas collapses isothermally with the aid of efficient $Ly{\alpha}$ emission during the transition from molecular-cooling halos to atomic-cooling halos. Because the local free-fall time of dense star-forming gas is very short (${\ll}1Myr$), a large fraction of the collapsed gas is turned into stars before stellar feedback processes blow out the gas and shut down star formation. Although the early stage of star formation is limited to a small region of the central star-forming disk, we find that the disk quickly fragments due to metal enrichment from supernovae. Sub-clusters formed in the fragmented clouds eventually merge with the main cluster at the center. The simulated clusters closely resemble the local GCs in mass and size but show a metallicity spread that is much wider than found in the local GCs. We discuss a role of pre-enrichment by Pop III and II stars as a potential solution to the latter issue. Although not without shortcomings, it is encouraging that a naive blind (not tuned) cosmological simulation presents a possible channel for the formation of at least some massive GCs.

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Spontaneous Vesicle Formation in Aqueous Mixtures of Cationic Gemini Surfactant and Sodium Lauryl Ether Sulfate

  • Cheon, Ho-Young;Jeong, Noh-Hee;Kim, Hong-Un
    • Bulletin of the Korean Chemical Society
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    • 제26권1호
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    • pp.107-114
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    • 2005
  • Molecular aggregates of surfactant molecules consisting of one or more bilayers arranged in a hollow, closed, usually spherical geometry are termed “esicles”or “iposomes” In recent years it has been found that in certain systems the vesicular structure forms spontaneously and is long lived, and it has been suggested that these structures may in fact constitute the equilibrium state in these cases (as is true of micelles) This paper deals with the mixed CMC, vesicles, phase behavior, phase transition, geometrical structure, their formation and characterization in the aqueous solutions of mixed cationic/anionic surfactants systems. TEM micrographs revealed that the vesicles were of spherical shape and that their size was of around 180 nm. The zeta potentials are positive at CGS1-rich regions and negative at SLES-rich regions. In the region where SLES/CGS1 (6/4), the zeta potentials are very small, implying that the vesicles at this surfactant ratio may be less stable. At other surfactant ratios, the vesicles are thought to be stable, supported by large absolute values of zeta potentials and little change in UV absorbance for several months.

다단 원판형 드래그펌프의 배기 성능에 관한 실험적 연구 (An Experimental Study on the Pumping Performance of the Multi-stage Disk-type Drag Pump)

  • 권명근;허중식;황영규
    • 한국진공학회지
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    • 제12권2호
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    • pp.79-85
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    • 2003
  • 다단 원판형 드래그펌프의 배기특성을 출구측 압력변화에 따른 입구측의 압력을 측정함으로써 파악하였다. 압력측정범위는 유량이 없을 때 출구측에서 0.13∼533 Pa로 하였다. 펌프 로터의 회전 속도는 24,000rpm이며, 질소가스를 사용하여 유량에 대한 성능실험을 수행하였다. 본 연구에서는 원판의 단의 수에 따른 원판형 드래그 펌프의 성능을 측정하였다. 3단, 2단, 단단형으로 원판형 드래그펌프를 구성하여 성능 실험하였으며, 최대도달진공도, 최대압축비, 배기속도등을 각각 측정하여 상호 성능을 비교·고찰하였다.

Asymmetrical Volume Loss in Hippocampal Subfield During the Early Stages of Alzheimer Disease: A Cross Sectional Study

  • Kannappan, Balaji
    • 통합자연과학논문집
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    • 제11권3호
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    • pp.139-147
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    • 2018
  • Hippocampal atrophy is a well-established imaging biomarker of Alzheimer disease (AD). However, hippocampus is a non-homogenous structure with cytoarchitecturally and functionally distinct sub-regions or subfield, with each region performing distinct functions. Certain regions of the subfield have shown selective vulnerability to AD. Here, we are interested in studying the effects of normal aging and mild cognitive impairment on these sub-regional volumes. With a reliable automated segmentation technique, we segmented these subregions of the hippocampus in 101 cognitively normal (CN), 135 early mild cognitive impairment (EMCI), 67 late mild cognitive impairment (LMCI) and 48 AD subjects. Thereby, dividing the hippocampus into hippocampal tail (tail), subiculum (SUB), cornu ammonis 1 (CA1), hippocampal fissure (fissure), presubiculum (PSUB), parasubiculum (ParaSUB), molecular layer (ML), granule cells/molecular layer/dentate gyrus (GCMLDG), cornu ammonis 3(CA3), cornu ammonis 4(CA4), fimbria and hippocampal-amygdala transition area (HATA). In this cross sectional study of 351 ADNI subjects, no differences in terms of age, gender, and years of education were observed among the groups. Though, the groups had statistically significant differences (p < 0.05 after the multiple comparison correction) in the Mini-Mental State Examination (MMSE) scores. There was asymmetrical volume loss in the early stages of AD with the left hemisphere showing volume loss in regions that were unaffected in the right hemisphere. Bilateral parasubiculum, right cornu ammonis 1, 3 and 4, right fimbria and right HATA regions did not show any volume loss till the late MCI stages. Our findings suggest that the hippocampal subfield regions are selectively vulnerable to AD and also that these vulnerabilities are asymmetrical especially during the early stages of AD.

분자선 에피택시를 이용하여 GaN 나노로드를 성장시 구조 및 광학적인 특성에 미치는 N2의 양의 효과 (Effect of N2 flow rate on growth and photoluminescence properties of GaN nanorods grown by using molecular beam epitaxy)

  • 박영신
    • 한국진공학회지
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    • 제16권4호
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    • pp.298-304
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    • 2007
  • rf 플라즈마 소스가 장착된 분자선 에피택시 장비를 이용하여 Si(111) 기판위에 GaN 나노로드를 성장할 때, N2의 흐름양을 조절하여 나노로드의 구조 및 광학적인 특성을 조사하였다. $N_2$의 양이 1.1sccm에서 2.0sccm으로 변할 때 육각형 모양의 나노로드가 성장되었으며, 평균 직경이 80nm에서 190nm 까지 변화 하였다. 그러나 나노로드와 compact한 영역의 길이 (두께)비는 $N_2$의 양이 1.7sccm 까지는 증가하지만 그 이상에서는 변화지 않았다. PL 측정으로부터, $N_2$의 양이 적은 나노로드에서 자유 엑시톤의 피이크가 더욱 뚜렷하게 관측되었고, 모든 PL 피이크의 위치는 직경이 적을수록 나노로드의 크기 효과에 의해서 고에너지 쪽으로 이동하였다. $N_2$의 양이 1.7sccm 인 시료에서는 온도에 따른 PL의 피이크의 위치가 온도가 증가함에 따라서 "S-형"의 거동을 나타내었다.

A STUDY OF LYNDS 1299 DARK CLOUD

  • RYU OK-KYUNGI;LEE YOUNGUNG
    • 천문학회지
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    • 제31권2호
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    • pp.161-171
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    • 1998
  • We have mapped about 1.5 square degree regions of Lynds 1299, a well isolated dark cloud in the Outer Galaxy (l = $122^{\circ}$, b = $-7^{\circ}$), in the J = 1- 0 transition of $^{12}CO$ and $^{13}CO$ with the 13.7 m radio telescope at Taeduk Radio Astronomy Observatory (TRAO). We found that there are two velocity components in the molecular emission, at $V_{LSR} = -52 km S^{-1}$ (Cloud A) and -8.8 km $s^{-1}$ (Cloud B), respectively. We have derived physical parameters of two molecular clouds and discussed three different mass estimate techniques. We found that there are large discrepancies between the virial and LTE mass estimates for both clouds. The large virial mass estimate reflects the fact that both are not gravitationally bound. We adopt the mass of $5.6 {\times}10^3 \;M{\bigodot}$ for Cloud A and $1.2{\times}10^3 \;M{\bigodot}$) for Cloud B using conversion factor. Cloud A is found to be associated with a localized star forming site, and its morphology is well matching with that of far-infrared (FIR) dust emission. It shows a clear ring structure with an obvious velocity gradient. We suggest that it may be a remnant cloud from a past episode of massive star formation. Cloud B is found to be unrelated to Cloud A (d = 800 pc) and has no specific velocity structure. The average dust color temperature of the uncontaminated portion of Cloud A is estimated to be 24$\~$27.4 K. The low dust temperature may imply that there is no additional internal heating source within the cloud. The heating of the cloud is probably dominated by the interstellar radiation field except the region directly associated with the new-born B5 star. Overall, the dust properties of Cloud A are similar to those of normal dark cloud even though it does have star forming activity.

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Molecular adaptation of the CREB-Binding Protein for aquatic living in cetaceans

  • Jeong, Jae-Yeon;Chung, Ok Sung;Ko, Young-Joon;Lee, Kyeong Won;Cho, Yun Sung;Bhak, Jong;Yim, Hyung-Soon;Lee, Jung-Hyun
    • 한국해양바이오학회지
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    • 제6권2호
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    • pp.102-109
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    • 2014
  • Cetaceans (whales, dolphins, and porpoises) are aquatic mammals that experienced drastic changes during the transition from terrestrial to aquatic environment. Morphological changes include streamlined body, alterations in the face, transformation of the forelimbs into flippers, disappearance of the hindlimbs and the acquisition of flukes on the tail. For a prolonged diving, cetaceans acquired hypoxia-resistance by developing various anatomical and physiological changes. However, molecular mechanisms underlying these adaptations are still limited. CREB-binding protein (CREBBP) is a transcriptional co-activator critical for embryonic development, growth control, metabolic homeostasis and responses to hypoxia. Natural selection analysis of five cetacean CREBBPs compared with those from 15 terrestrial relatives revealed strong purifying selection, supporting the importance of its role in mammals. However, prediction for amino acid changes that elicit functional difference of CREBBP identified three cetacean specific changes localized within a region required for interaction with SRCAP and in proximal regions to KIX domain of CREBBP. Mutations in CREBBP or SRCAP are known to cause craniofacial and skeletal defects in human, and KIX domain of CREBBP serves as a docking site for transcription factors including c-Myb, an essential regulator of haematopoiesis. In these respects, our study provides interesting insights into the functional adaptation of cetacean CREBBP for aquatic lifestyle.