• Title/Summary/Keyword: Molecular structures

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Effect of chemical letting on the fiber seperation of Kenaf bast (케냐프 섬유 분리에 대한 화학적 레팅효과)

  • 이혜자;한영숙;유혜자;김정희;송경헌;안춘순
    • Journal of the Korean Society of Clothing and Textiles
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    • v.27 no.9_10
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    • pp.1144-1152
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    • 2003
  • Kenaf has been cultivated in Jeju Island. After being harvested at 105 DAP(day after planting) and separated from kenaf stalks , decorticated kenaf basts were treated with different concentration/temperature/time combinations in order to do chemical rotting. The following fiber properties were compared; rotting effects, colors, crystallinity, molecular structures, dyeabilities, and non-cellulose contents such as pectins, lignins, & hemicellulose. The best results of chemical rotting were obtained from the specimens treated with low concentration/ low temperature/short time. Their colors were bright yellow. The lumens of specimens diminished with the affect of NaOH. The structures of chemically rotted kenaf fibers were cellulose 1. The degree of crystallinity of chemically retted kenaf fibers were very high. Non-cellulose content, especially hemicellulose, was low in the specimens treated with the high NaOH concentration. Dyeabilities of kenaf fibers were higher among the specimens without the non-cellulose content than those with the non-cellulose content.

Replication of label-free biosensor with nano grating structures (나노 그래이팅 구조를 갖는 비표지식 바이오센서 성형에 관한 연구)

  • Cho, E.H.;Kim, B.W.;Choi, S.W.;Kim, K.H.;Sung, G.Y.;Kang, S.
    • Proceedings of the Korean Society for Technology of Plasticity Conference
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    • 2009.05a
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    • pp.290-293
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    • 2009
  • This paper presents the development of a disposable label-free biosensor for bio molecular interaction analysis. Label-free biosensors have advantages of high performance in sensitivity and short detection time. Among various label-free systems, we introduced biosensor with nano grating structures based on white light source and spectrometer. And to develop high efficiency label-free biosensor, we suggest replicating processes satisfying required specification. We also report a system set-up to evaluate the characteristics of phenomenon shown in this biosensor system.

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All-Organic Nanowire Field-Effect Transistors and Complementary Inverters Fabricated by Direct Printing

  • Park, Gyeong-Seon;Seong, Myeong-Mo
    • Proceedings of the Korean Vacuum Society Conference
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    • 2013.02a
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    • pp.632-632
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    • 2013
  • We generated single-crystal organic nanowire arrays using a direct printing method (liquidbridge- mediated nanotransfer molding) that enables the simultaneous synthesis, alignment and patterning of nanowires from molecular ink solutions. Using this method, single-crystal organic nanowires can easily be synthesized by self-assembly and crystallization of organic molecules within the nanoscale channels of molds, and these nanowires can then be directly transferred to specific positions on substrates to generate nanowire arrays by a direct printing process. The position of the nanowires on complex structures is easy to adjust, because the mold is movable on the substrates before the polar liquid layer, which acts as an adhesive lubricant, is dried. Repeated application of the direct printing process can be used to produce organic nanowire-integrated electronics with twoor three-dimensional complex structures on large-area flexible substrates. This efficient manufacturing method is used to fabricate all-organic nanowire field-effect transistors that are integrated into device arrays and inverters on flexible plastic substrates.

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A Theoretical Study of Some Bicyclic Azoalkanes

  • Chung, Gyu-Sung;Lee, Duck-Hwan
    • Bulletin of the Korean Chemical Society
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    • v.27 no.12
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    • pp.2051-2054
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    • 2006
  • The molecular structures of the ground and lowest triplet states of 2,3-diazabicyclo[2.2.1]hept-2-ene (DBH), 2,3-diazabicyclo[2.2.2]oct-2-ene (DBO) and their fused ring derivatives are investigated with an ab initio method and the density functional theory. Unlike the singlet DBH and DBO, the azo skeletal structures of the triplet counterparts are turned out to be quite sensitive to the change of the electronic structure of the fused ring. The B3LYP C-N=N-C dihedral angles of the triplet DBH and DBO are estimated to be about 28.0 and $40.4{^{\circ}}$, respectively. The B3LYP singlet-triplet energy gaps for DBH and DBO are predicted to be 58.4 and 48.4 kcal/mol, respectively. The triplet state energy can be lowered drastically by the presence of the remote $\Pi-\Pi$ interaction as in the case of 1bb'.

Ab initio and Vibrational Predissociation Studies on Methylammonium-(Water)4 Complex: Evidence for Multiple Cyclic and Non-cyclic Hydrogen-bonded Structures

  • Kim, Kwang-Yon;Han, Woon-Hui;Cho, Ung-In;Lee, Yuan T.;Boo, Doo-Wan
    • Bulletin of the Korean Chemical Society
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    • v.27 no.12
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    • pp.2028-2036
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    • 2006
  • The combined ab initio and vibrational predissociation (VP) spectroscopic studies on methylammonium-$(water)_4$ complex aimed at understanding the hydration behavior of an amphiphilic ion core are described. The ab initio calculations predicted eleven low-energy isomers forming cyclic, tripod, chain, and caged structures, and their relative stabilities, total hydration energies and thermodynamic functions at 298 K and 150 K. The excellent correlation between the observed VP spectra and ab initio spectra for bonded N-H, bonded O-H and free O-H stretches suggested co-existence of five cyclic isomers and two non-cyclic isomers in ion beam at 150 K, consistent with the trends of calculated Gibbs free energies.

Friction and Wear Simulation of Suspended Silicon Asperity Moving over a Plate at Microscale

  • Cho, Sung-San;Kim, Jung-Soo;Park, Seung-Ho
    • International Journal of Safety
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    • v.5 no.1
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    • pp.10-16
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    • 2006
  • A suspended hemispherical silicon asperity moving over a silicon plate was simulated. The simulation results on friction and wear in the interface between the two can help obtain more durable miscroscale structures. Silicon structures were constructed with Tersoff three-body potential. Dependence of friction and wear of the asperity on both the atomic arrangement in the plate and the moving direction was investigated under the condition that the asperity is subject to the attractive normal force due to the plate. The results show that the variation of friction force with the movement of asperity, and the occurrence of adhesive wear are attributed to the formation and rupture of asperity, junction between the asperity and the plate. The friction force and wear are smaller when the asperity is incommensurate with the plate, and they also depend on the moving direction of the asperity over the plate.

Ab Initio Calculated Structures and Vibrational Spectra of 1,3-Diethoxy-p-tert-butylcalix[4]crown-5-ether Complexed with Potassium Cation

  • Choe, Jong-In
    • Bulletin of the Korean Chemical Society
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    • v.28 no.2
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    • pp.235-240
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    • 2007
  • Molecular structures were optimized for the 1,3-diethoxycalix[4]crown-5-ether (2) in the various isomers and their potassium-ion complexes by using B3LYP/6-31+G(d,p)//B1LYP/6-31G(d,p) method after ab initio RHF/6-31G calculation. The cone-shaped isomer of 2 with cr-binding mode has shown the strongest binding efficiency among the six different complexes attributed to seven electrostatic interactions between the potassium cation and the oxygen atoms of crown-5-ether and ethoxy groups of the host (2). The vibrational spectra of 2 and its K+-complexes were obtained by restricted Hartree-Fock (RHF) calculations with the 6-31G basis set. The characteristic vibrational frequencies of various C-O-C stretching and bending motions are analyzed.

Effects of the Superlattices on STM Imaging of Self-organized Substituted Alkyl Chain Monolayers on a Graphite Surface

  • Son, Seung Bae;Hahn, Jae Ryang
    • Bulletin of the Korean Chemical Society
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    • v.33 no.12
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    • pp.4155-4160
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    • 2012
  • We characterized the physisorption of p-iodo-phenyl octadecyl ether molecules (I-POE) onto superlattice regions of graphite surfaces using scanning tunneling microscopy (STM). The formation of self-organized I-POE monolayers does not affect the overall structures of moir$\acute{e}$ patterns and their modulation periods. However, the packing density of the I-POE monolayer and the orientations of lamella structures were sensitive to the underlying superlattice structure. Depending on the bias voltage, the STM images selectively showed moir$\acute{e}$ pattern, I-POE layer, or both. Reflecting the local density of states at a certain energy level, the STM images thereby revealed the relative energy level scale of the superlattice with respect to the molecular orbitals of I-POE.

Molecular Orbital Studies of Bonding Characters of Al-N, Al-C, and N-C Bonds in Organometallic Precursors to AIN Thin Films

  • 이기학;박성수;이한명;박수진;박항수;이윤섭;김윤수;김세훈;조찬균;은희만
    • Bulletin of the Korean Chemical Society
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    • v.19 no.12
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    • pp.1314-1319
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    • 1998
  • Electronic structures and properties of the organometallic precursors [Me2AlNHR]2 (R =Me, iPr, and tBu) have been calculated by the semiempirical (ASED-MO, MNDO, AM1 and PM3) methods. Optimized structures obtained from the MNDO, AM1, and PM3 calculations indicate that the N-C bond lengths are considerably affected by the change of the R groups bonded to nitrogen, but the bond lengths of the Al-N and Al-C bonds are little affected. This result is useful in explaining the experimental results for the elimination of the R groups bonded to nitrogen, and could serve as a guide in designing an optimum precursor for the AlN thin film formation.

Nuclear structures and their emerging roles in cell differentiation and development

  • Hye Ji Cha
    • BMB Reports
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    • v.57 no.9
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    • pp.381-387
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    • 2024
  • The nucleus, a highly organized and dynamic organelle, plays a crucial role in regulating cellular processes. During cell differentiation, profound changes occur in gene expression, chromatin organization, and nuclear morphology. This review explores the intricate relationship between nuclear architecture and cellular function, focusing on the roles of the nuclear lamina, nuclear pore complexes (NPCs), sub-nuclear bodies, and the nuclear scaffold. These components collectively maintain nuclear integrity, organize chromatin, and interact with key regulatory factors. The dynamic remodeling of chromatin, its interactions with nuclear structures, and epigenetic modifications work in concert to modulate gene accessibility and ensure precise spatiotemporal control of gene expression. The nuclear lamina stabilizes nuclear shape and is associated with inactive chromatin regions, while NPCs facilitate selective transport. Sub-nuclear bodies contribute to genome organization and gene regulation, often by influencing RNA processing. The nuclear scaffold provides structural support, impacting 3D genome organization, which is crucial for proper gene expression during differentiation. This review underscores the significance of nuclear architecture in regulating gene expression and guiding cell differentiation. Further investigation into nuclear structure and 3D genome organization will deepen our understanding of the mechanisms governing cell fate determination.