• 제목/요약/키워드: Side chain

검색결과 659건 처리시간 0.03초

머신 러닝을 통한 단백질의 자유 에너지 예측

  • 이광중;함시현
    • EDISON SW 활용 경진대회 논문집
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    • 제6회(2017년)
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    • pp.95-99
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    • 2017
  • Protein contact map은 단백질 삼차구조에 대한 정보를 이차원의 이미지로 표현하는 방법의 하나로, 비교적 간략하지만 단백질 구조에 대한 핵심적 정보를 함축하고 있다. 이러한 단백질 구조를 바탕으로 단백질의 internal energy, solvation free energy, free energy 와 같은 열역학 함수를 도출할 수 있다. 본 연구에서는 이미지 인식에 대한 머신러닝 기법을 사용하여 단백질 구조를 함축하는 단백질의 contact map으로부터 단백질의 열역학적 함수를 예측하는 연구를 진행하였다. 단백질의 main-chain 간의 contact map, side-chain 간의 contact map, main-chain과 side-chain 간의 contact map 들로부터 단백질의 여러 가지 열역학적 함수를 예측하고자 했으며 최종적으로 Convolution Neural Network (CNN) 기법을 사용하여 단백질의 free energy를 ~18 kcal/mol의 범위에서 예측 가능함을 보였다. 본 연구를 바탕으로 단백질의 contact map과 열역학 함수 사이의 상관관계가 있으며, 머신러닝 기법을 사용하여 단백질 contact map으로부터 열역학적 함수를 예측하는 것이 가능함을 보였다.

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Control of liquid crystal pretilt angle using polyimide mixture

  • Kang, Dae-Seung;Lee, Ji-Hoon;Rosenblatt, Charles
    • 한국정보디스플레이학회:학술대회논문집
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    • 한국정보디스플레이학회 2008년도 International Meeting on Information Display
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    • pp.1577-1579
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    • 2008
  • A mixture of two different types of polyimide, one having an alkyl side chain and ordinarily used for homeotropic alignment, and the other without a side chain and ordinarily used for planar alignment, is deposited and baked at high temperatures. When the resulting cell is filled with a nematic liquid crystal, it is found that the pretilt angle is a function of the baking temperature or mixing ratio, and can be controlled continuously over the range 0 to 90.

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Novel Homeotropic Alignment Materials with Alkylcyclohexylbenzene as Side Chain in Polyimides

  • Lee, H.K.;Kim, Y.B.
    • 한국정보디스플레이학회:학술대회논문집
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    • 한국정보디스플레이학회 2003년도 International Meeting on Information Display
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    • pp.600-603
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    • 2003
  • VA-LCDs is widely used for recent LCD productions owing to wide viewing angle characteristics with an unusually high contrast ratio. To apply for VA-LCDs, the novel homeotropic alignment materials were synthesized, which have the liquid crystal molecule as a side chain at aromatic diamine in a polyimide structure. These polyimides generated a high pretilt angle $90^{\circ}C$. In this paper, the synthesis and alignment properties of new homeotropic alignment materials will be discussed..

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Synthesis of Side-Chain Nonlinear Optical Polymers with Carbazolylnitrostilbene Chromophores

  • 김동욱;홍성일;박수영;김낙중
    • Bulletin of the Korean Chemical Society
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    • 제18권2호
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    • pp.198-203
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    • 1997
  • Two different carbazolylnitrostilbene chromophores with second-order nonlinear optical (NLO) activity were newly synthesized by the reaction of 9-(2-hydroxyethyl)-9H-carbazol-3-carbaldehyde with 4-nitrophenylacetonitrile or 4-nitrophenylacetic acid. The NLO monomers were obtained by reaction of these chromophores with methacryloyl chloride. The side-chain nonlinear optical polymers were synthesized by the copolymerization of NLO monomer with methylmethacrylate using a free radical initiator. The chemical structures of the polymers were identified by spectroscopic means and the polymer properties such as molecular weight, Tg, solubility, UV-visible absorption, and second-harmonic generation (SHG) coefficients were investigated.

지지면에 따른 닫힌 사슬운동이 성인의 균형에 미치는 영향 (Effects of a Closed Chain Movement of the Support Surface on the Balance of Adults)

  • 문성기;이상호
    • 신경치료
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    • 제22권3호
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    • pp.19-23
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    • 2018
  • Purpose The purpose of this study was to investigate the change of balance ability by performing closed chain exercise on stable support surface and unstable support surface in twenties. Methods This study randomly selected 15 students in the closed chain exercise group on the stable support side and 15 on the closed chain exercise group on the unstable support side. Balance ability was measured before and after the start of exercise and static balance was measured by OLT(One Leg Standing Test) and FRT (Functional Reach Test). Result The changes of the function reach test of the closed chain movement according to the ground type were significant in the unstable and stable support surfaces and the change of function reach test after the intervention in the two groups was significantly improved compared with the closed chain movement respectively. The one leg standing test changes of the closed chain movement according to the ground type showed significant results on the unstable and stable support surfaces, but there was no significant difference in the one leg standing test changes after intervention between the two groups. Conclusion The effect of closed chain training on ground type is unstable. The change of function reach test and one leg standing test of the closed chain exercise group on the stable support surface resulted in significant changes after exercise, but there was a significant difference in the balance ability of function reach test change after intervention between the groups.

아크릴계 점착제와 초박형 웨이퍼소재와의 점착특성 - 아크릴 중합체의 측쇄의 영향 - (Adhesion Characteristics of Acrylic Pressure Sensitive Adhesives on Thin Wafer Materials - Effect of Acrylic Copolymer Side Chain -)

  • 유종민;남영희;이승현;김형일;임동혁;김현중;김경만
    • 접착 및 계면
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    • 제10권3호
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    • pp.134-140
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    • 2009
  • 분자설계를 통하여 측쇄를 변화시킨 아크릴공중합체를 합성하여 아크릴공중합체 점착제와 초박형웨이퍼와의 젖음성 및 점착물성을 조사하였다. 선형 아크릴공중합체를 에폭시계 Tetra-DX 가교제와 반응시켜 3차원 망상구조를 형성하고 가교의 영향을 조사하였다. 계면상호작용보다는 아크릴공중합체의 측쇄변화가 젖음성에 더 큰 영향을 미쳤다. 가교도가 증가할수록 probe tack, peel strength가 감소하는 경향을 나타냈다. 가교에 의해 SAFT 내열성이 증가하였지만 가교제의 함량이 증가하면 오히려 SAFT 내열성이 감소하였다.

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유연한 곁사슬을 갖는 방향족 Poly(ether-ether-ester)의 합성 및 성질 (Synthesis and Properties of Aromatic Poly(ether-ether-ester)s having Flexible Side Chain)

  • 방문수
    • 한국산학기술학회논문지
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    • 제10권11호
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    • pp.3060-3065
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    • 2009
  • 알콕시 곁사슬을 갖는 유연한 곁사슬을 갖는 전방향족 Poly(ether-ether-ester)가 ether기로 연결된 triad diol과 2,5-dialkoxyterephthalic acid로부터 direct polycondensation에 의하여 합성되었다. 중합체의 구조와 물리적 성질은 1H-NMR, FT-IR, DSC, TGA를 이용하여 조사되었다. 연구결과에 의하면, 용매로서 1,1,2,2-tetrachloroethane(TCE)를 사용하여 측정된 고분자의 고유점성도는 0.45~0.86 이/g의 값을 나타내었으며, 질소 분위기하에서 측정된 초기열분해온도는 378~418 $^{\circ}C$를 나타내었다. 중합체 대부분은 측정에 사용된 유기용매에 용해되었고, 용융전이온도(Tm)는 곁사슬의 길이가 길수록 감소되었으며 홀수-짝수 효과를 나타내었다.

Cholesteryl crotonate의 구조 (Structure of Cholesteryl Crotonate)

  • 박영자;신정미
    • 한국결정학회지
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    • 제13권1호
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    • pp.21-24
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    • 2002
  • Cholesterol crotonate(CH₃CH = CHCOOC/sub 27/H/sub 45/)의 분자 및 결정 구조를 X-선 회절법으로 연구하였다. 결정은 P2₁, a = 13.446(4) , b = 11.802(3) , c = 18.782(5) , β = 103.99(2)°, Z = 4이다. 회절 반점들의 세기는 흑연 단색화 장치가 있는 Enraf-Nonius CAD-4 diffractometei로 얻었으며 (2θ/sub max/ = 25°, Mo-Kα X선(λ= 0.7107 )을 사용하였다. 분자 구조는 직접법으로 풀었으며, 최소자승법으로 정밀화하였고, 최종신뢰도 R값은 1604개의 회절 반점에 대하여 0.092이었다. 화합물의 결정 구조는 cholesterol ethylcarbonate, propylcarbonate, crotylcarbonate등의 결정 구조와 isostructure로, 분자들은 monolayer를 이루면서 쌓여 있으며, monolayer 중심부에서는 A 분자의 cholesteryl ring system들끼리, B 분자의 cholesterol ring system과 분자 B의 C(17)-side chain들이 서로 촘촘히 쌓여있다. 층(layer)들 사이에는 crotonate tail들과 분자 A의 C(17)-side chain들이 느슨하게 모여있다. 결정은 cholesteric phase를 갖는 liquid crystalline state을 보여주고 있다.

닫힌-사슬 운동이 뇌졸중 환자의 체중지지율과 균형능력에 미치는 영향 (The Effect of Closed-Chain Exercise on Weight Supporting Rate and Balance Ability in Stroke Patients)

  • 김희권
    • PNF and Movement
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    • 제9권1호
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    • pp.1-9
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    • 2011
  • Purpose : The purpose of this study is to analyze the effect of closed-chain exercise on weight supporting rate change within hemiplegic side and static dynamic balance ability in stroke patients. Methods : The subjects of the study were 13 hemiplegic patients who carried out closed-kinematic chain exercise program over 6 weeks. The exercises of the program are stand to sit with stall bar, stair-up & down by a hemiplegic leg and bridging exercise crossing the non-hemiplegic leg onto the hemiplegic leg. Each exercise was carried out over 3 sets of 10reps. Results : The results of this study were summarized as follows: 1. After intervention, there was a statistically significant change in the weight supporting rate within hemiplegic and non-hemiplegic side(P<0.05). 2. After intervention, there was a statistically significant change in the static balance(FICSIT-4) ability(P<0.05). 3. After intervention, there was a statistically significant change in the dynamic balance(FSST, TUG, FRT) ability(P<0.05). Conclusion : The results of the study suggests that closed-chain exercise program in stroke patients improves their weight supporting rate and enhance the static dynamic balance.

낙엽송(落葉松) 추출성분(抽出成分) 이용(利用)에 관(關)한 기초연구(基礎硏究) (Studies on the Characteristics of Extractives in Japanese Larch (Larix leptolepis Gordon) Grown in Korea)

  • 조남석;이종윤;안원영
    • Journal of the Korean Wood Science and Technology
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    • 제10권2호
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    • pp.12-21
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    • 1982
  • Red pine and Japanese larch (Larix leptolepis Gordon) grown in Korea have been the main species of coniferous resources in Korea. Especially, planting area of Japanese larch has been increased continueously in the recent years due to its superior plant type and rapid growth rate and its stocks reached approximately 4.32 million cubic meters at the present time. Although many research works have been done for the utilization of the larch wood in various ways, still many problems are existed in its chemical applications due to a large proportion of soluble extractives. In this study, chemical composition of larch extractives and chemical structure of its major component were analyzed. In order to identify the basic structure of major component, gas-liquid chromatography for separation of some completely methylated alditols as their acetates on a 3% - ECNSS-M on Gas Chrom Q. column was used. Proportion of extractives of Japanese larch wood was higher than that of other conifers and major component of the soluble extractives was arabinogalactan, a schematic structural formula which was presented in Figure 2. The molar ratio of arabinose and galactose was 1:4.5. The main chain of arabinogalactan was composed of 1,3 linked ${\beta}$-D-galactopyranose residues, each of which carried a side chain, attached to the C-6 positions. The exact nature of all of the side chains is not known, but the majority of these side chain was composed of 1, 6 linked ${\beta}$-D-galactopyranose residues, with 2~3 such units present per average chain. Some of the galactose units in the main chain had a residue of 3 - 0 - ${\beta}$-L-arabinopyranosyl-L-arabinofuranose. In addition, a few terminal residues of D-glucuronic acid also was confirmed, attached to C-6 position of the D-galactopyranose residue. It could concluded that the main structure of highly branched arabinogalactan from Japanese larch extractive was essentially the same as those of the other larch species.

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