• Title/Summary/Keyword: CoQ10

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Ligand Based CoMFA, CoMSIA and HQSAR Analysis of CCR5 Antagonists

  • Gadhe, Changdev G.;Lee, Sung-Haeng;Madhavan, Thirumurthy;Kothandan, Gugan;Choi, Du-Bok;Cho, Seung-Joo
    • Bulletin of the Korean Chemical Society
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    • v.31 no.10
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    • pp.2761-2770
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    • 2010
  • In this study, we have developed QSAR models for a series of 38 piperidine-4-carboxamide CCR5 antagonists using CoMFA, CoMSIA and HQSAR methods. Developed models showed good statistics in terms of $q^2$ and $r^2$ values. Best predictions obtained with standard CoMFA model ($r^2$ = 0.888, $q^2$ = 0.651) and combined CoMSIA model ($r^2$ = 0.892, $q^2$ = 0.665) with electrostatics and H-bond acceptor parameter. The validity of developed models was assessed by test set of 9 compounds, which showed good predictive correlation coefficient for CoMFA (0.804) and CoMSIA (0.844). Bootstrapped analysis showed statistically significant and robust CoMFA (0.968) and CoMSIA (0.936) models. Best HQSAR model was obtained with a $q^2$ of 0.662 and $r^2$ of 0.936 using atom, connection, hydrogen, donor and acceptor as parameters and fragment size (7-10) with optimum number of 6 components. Predictive power of developed HQSAR model was proved by test set and it was found to be 0.728.

Effects of Elevated $CO_2$ Concentration and Temperature on Growth Response of Quercus acutissima and Q. variabilis (지구온난화에 따른 상수리나무와 굴참나무의 생육반응에 관한 연구)

  • Jeong, Jung-Kyu;Kim, Hae-Ran;You, Young-Han
    • Korean Journal of Environment and Ecology
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    • v.24 no.6
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    • pp.648-656
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    • 2010
  • Global warming brings changes of natural ecosystems and affects on the plant growth response. Quercus acutissima and Q. variabilis are taxonomically similar and dominant native species in deciduous forests in South Korea. In order to understand the growth response of Q. acutissima and Q. variabilis to global warming condition, we cultivated the seedling of the two oak species in ambient condition(control) and treatment with elevated $CO_2$(700~800ppm) and increased air temperature(approximately $3^{\circ}C$ above than control). Then we measured the growth characteristic among them and analyzed the relationship between two species using PCA ordination. Stem length and total plant weight of Q. acutissima were significantly affected by elevated $CO_2$ concentration and increased air temperature. Stem diameter and weight of Q. variabilis were significantly affected by elevated $CO_2$ concentration and increased air temperature(p<0.05). The variation characteristics of Q. acutissima were changed more than Q. variabilis by elevated $CO_2$ concentration and increased air temperature. These result suggested that Q. acutissima was more sensitive to global warming situation than Q. variabilis in central region of Korea. PCA ordination showed that two species were arranged by two distinct groups based on 10 characters by elevated $CO_2$ and increased air temperature.

Synthesis and Optical Properties of Acrylic Copolymers Containing AlQ3 Pendant Group for Organic Light Emitting Diodes

  • Kim, Eun-Young;Myung, Sung-Hyun;Lee, Young-Hee;Kim, Han-Do
    • Clean Technology
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    • v.18 no.4
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    • pp.366-372
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    • 2012
  • Three acrylic copolymers containing tris(8-hydroxyquinoline) aluminum (AlQ3) pendant group (25 wt%), acrylateco-HEMA-$AlQ_3$ (25 wt%), were successfully synthesized by free radical polymerization from acrylates [methyl methacrylate (MMA), acrylonitrile (AN) or 2-hydroxyethyl methacrylate (HEMA)] with HEMA functionalized with AlQ3 pendant groups (HEMA-p-$AlQ_3$). The glass transition temperatures ($T_g$) of MMA-co-HEMA-p-$AlQ_3$ (copolymer 1), AN-co-HEMA-p-$AlQ_3$ (copolymer 2) and HEMA-co-HEMA-p-$AlQ_3$ (copolymer 3) were found to be 158, 150 and $126^{\circ}C$, respectively. They have good thermal stability: a very desirable feature for the stability of OLEDs. Their solubility, thermal properties, UV-visible absorption and photoluminescence behaviors were investigated. They were found to be soluble in various organic solvents such as tetrahydrofuran (THF), dimethylformamide (DMF), toluene and chloroform. It was also found that the UV-visible absorption and photoluminescence behaviors of these copolymers were similar to those of pristine $AlQ_3$. Green organic light-emitting diodes (OLEDs) have also been fabricated using these copolymers as light emission/electron transport components obtained easily by spin coating, and their current density voltage (J-V) curves were compared. The OLED device of the copolymer 3 had the lowest turn-on voltage of about 2 V compared to other copolymer types devices.

Effects of Elevated CO2 and Temperature on the Leaf Morphological Responses of Quercus serrata and Quercus aliena, Potential Natural Vegetation of Riverine (CO2농도 및 온도 상승이 하천변 잠재자연식생인 졸참나무와 갈참나무 잎의 형태학적 반응에 미치는 영향)

  • Cho, Kyu-Tae;Kim, Hae-Ran;Jeong, Heon-Mo;You, Young-Han
    • Journal of Wetlands Research
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    • v.15 no.2
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    • pp.171-177
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    • 2013
  • This study was conducted to find the leaf morphological responses of Quercus serrata and Q. aliena which are potential natural vegetation of riverine in Korea under elevated $CO_2$ and increased temperature. Rising $CO_2$ concentration was treated with 1.6 times than control(ambient) and increased temperature with $2.2^{\circ}C$ above the control(ambient) in the glass greenhouse. As a result, leaf width length, leaf lamina weight and leaf area of Q. serrata and Q. aliena was respectively increased, and number of leaves and specific leaf area(SLA) was decreased by elevated $CO_2$ and temperature. Leaf width length, leaf lamina length, leaf lamina weight, number of leaves, leaf area, and specific leaf area of Q. serrata were not statistically significant difference between control and treatment. Leaf width length and leaf weight of Q. aliena was increased, but specific leaf area was decreased. These results indicated that Q. aliena was to be sensitive than Q. serrata in response to global warming situation. According to the principal component analysis(PCA), two oak species were arranged based on factor 1 and 2 in the control and warming treatment. And change on the warming treatment was clearly distinguishable from the Q. aliena than Q. serrata.

Sensitivity Analysis (Q10) of Carbon Dioxide Flux with Soil Temperature in the Grassplot (잔디밭에서 지온에 대한 이산화탄소 플럭스의 민감도(Q10) 분석)

  • Kang, Dong-hwan;So, Yoon Hwan;Kwon, Byung Hyuk;Kim, Park Sa
    • Journal of Environmental Science International
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    • v.28 no.9
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    • pp.785-795
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    • 2019
  • In order to analyze the sensitivity of carbon dioxide flux by soil temperature in the grassplot, carbon dioxide flux and soil temperature were observed 24 times from March, 2010 to March, 2011 at nine sites in the grassplot. The average of $CO_2$ in the grassplot is $2.2{\sim}36.7^{\circ}C$, the highest in August, the lowest in January, and the average of carbon dioxide flux is $12{\sim}1479mgCO_2{\cdot}m^{-2}{\cdot}hr^{-1}$, and the carbon dioxide emission from the grassplot to the atmosphere was 10 times higher in summer than in winter. The temperature response coefficient estimated by the exponential function of carbon dioxide flux according to soil temperature was ranged from 0.1065 to 0.1274, and the increase tendency of $CO_2$ flux with soil temperature was linear at $0{\sim}20^{\circ}C$ and exponential at $20{\sim}40^{\circ}C$. The $Q_{10}$ values for each of nine observation sites on the grassplot was in the range of 2.901 ~ 3.575, and the $Q_{10}$ value using the total data observed in the lawn was estimated to be 3.374. In the homogeneous grassplot area, the average of $Q_{10}$ values by observation point and the $Q_{10}$ value by the total data were estimated similarly.

Soil CO2 Efflux and Leaf-Litter Decomposition of Quercus variabilis and Pinus densiflora Stands in the Southern Region of Korean Peninsular

  • Kim, Sung Bin;Jung, Nam Chul;Lee, Kye-Han
    • Journal of Korean Society of Forest Science
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    • v.98 no.2
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    • pp.183-188
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    • 2009
  • It is necessary to determine the amount of carbon dioxide ($CO_2$) absorbed by plants and released from forest floor into atmosphere, to gain a better understanding how forests participate in the global carbon cycle. Soil $CO_2$ efflux, litter production, and decomposition were investigated in Q. variabilis and P. densiflora stands in the vicinity of Gwangju, Chonnam province. Soil $CO_2$ efflux was measured using Infrared Gas Analyzer (IRGA) at midday of the 10th day at every month over 12-month period, to quantify seasonal and annual budgets of soil $CO_2$ efflux. Soil temperature and soil moisture were measured at the same time. Seasonal soil $CO_2$ efflux in Q. variabilis and P. densiflora were the highest in summer season. In August, maximum soil $CO_2$ efflux in Q. variabilis and P. densiflora was 7.49, $4.61CO_2{\mu}mol{\cdot}m^{-2}{\cdot}s^{-1}$, respectively. Annual $CO_2$ efflux in each stand was 1.77, $1.67CO_2kg{\cdot}m^{-2}$ respectively. Soil $CO_2$ efflux increased exponentially with soil temperature and related strongly in Q. variabilis ($r^2$=0.96), and in P. densiflora ($r^2$=0.91). Litter production continued throughout the year, but showed a peak on November and December. Annual litter production in the Q. variabilis and P. densiflora stands were $613.7gdw{\cdot}m^{-2}{\cdot}yr^{-1}$ and $550.5gdw{\cdot}m^{-2}{\cdot}yr^{-1}$.$yr^{-1}$, respectively. After 1 year, % remaining mass of Q. variabilis and P. densiflora litter was 48.2, 57.1%, respectively. The soil $CO_2$ efflux rates in this study showed clear seasonal variations. In addition, the temporal variation in the $CO_2$ efflux rates was closely related to the soil temperature fluctuation rather than to variations in the soil moisture content. The range of fluctuation of soil $CO_2$ efflux and litter decomposition rate showed similar seasonal changes. The range of fluctuation of soil $CO_2$ efflux and litter decomposition rate was higher during summer and autumn than spring and winter.

Analysis of CO2 Fixation Capacity in Leaves of Ten Species in the Family Fagaceae (제주도 자생 참나무과 식물의 대기 중 CO2 흡수 능력의 비교분석)

  • Oh, Soon-Ja;Shin, Chang-Hoon;Kim, Chul-Soo;Kang, Hee-Suk;Kang, Kyeng-Min;Yang, Yun-Hi;Koh, Seok-Chan
    • Journal of Environmental Science International
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    • v.21 no.1
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    • pp.89-96
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    • 2012
  • The rate of photosynthesis (A) of leaves from 10 plant species (6 evergreen and 4 deciduous) of the family Fagaceae was measured using a portable photosynthesis analyzer, to examine which species take up $CO_2$ most efficiently. Of the evergreen species, the photosynthetic rate of Castanopsis cuspidata var. sieboldii was highest, and remained above 82.1~106.4 ${\mu}mol\;kg^{-1}s^{-1}$ from July to November. Of the deciduous species, the photosynthetic rate of Quercus acutissima was higher than that of the other three species, and remained high at 83.5~116.6 ${\mu}mol\;kg^{-1}s^{-1}$ from September to November. The photosynthetic rate of the 10 species was positively correlated with stomatal conductance (gs) and transpiration rate (E). However, there was no correlation between photosynthetic rate and intercellular $CO_2$ concentration ($C_i$), although there was a positive correlation just in three species (Q. gilva, Q. acutissima and Q. glauca). These results suggest that the $CO_2$ fixation capacity of C. cuspidata var. sieboldii, an evergreen species, and Q. acutissima, a deciduous species, is significantly higher than that of the other species examined, and that photosynthesis is regulated by both stomatal conductance and transpiration. Therefore, C. cuspidata var. sieboldii and Q. acutissima may be valuable for the evaluation of carbon uptake in urban green spaces as well as in afforested areas.

ANTI-AGING EFFECTS OF UBIQUINONE-10 (CoQ-10) ON HUMAN SKIN CELLS

  • Okano, Y.;Kurihara, K.;Obayashi, K.;Masaki, H.;Kurata, Y.
    • Proceedings of the SCSK Conference
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    • 2003.09a
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    • pp.320-326
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    • 2003
  • Recently several studies have indicated that ubiquinone-l0 (CoQ-10) decrease with aging in various organs of the human body. The decrease of ubiquinone-10 in the aging process suggests the reduction of both energy production in mitochondria and anti-oxidation with aging. Based on these findings, Ubiquinone-10 is being focused at as an anti-aging agent in the cosmetic market.(omitted)

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Magnetic Properties of SmCo Thin Films Grown by Using a Nd-YAG Pulsed Laser Ablation Method (Nd-YAG Pulsed Laser Ablation법으로 제작한 SmCo계 박막의 자기특성)

  • 김상원;양충진
    • Journal of the Korean Magnetics Society
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    • v.10 no.1
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    • pp.30-36
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    • 2000
  • SmCo films were deposited on Si(100) substrate by a Nd-YAG pulsed laser ablation of the targets of Sm$\_$100-x/Co$\_$x/ (73$\leq$x$\leq$93) at the substrate temperature of 600∼700$\^{C}$ and the laser beam energy density of Q switching mode or fixed Q mode. The magnetic properties of the films obtained from the Q switching mode exhibited a 4 $\pi$ Ms of 5200∼7700 Gauss, iHc of 190-250 Oe, and 4$\pi$M$\_$r//4$\pi$M$\_$s/ of 0.4∼0.74, respectively, while the fixed Q mode gave the magnetic properties of corresponding films of a 4$\pi$M$\_$r//4$\pi$M$\_$s/ = 0.32∼0.91 and iHc of 430-6290 Oe, respectively. The fixed Q mode gave the better magnetic properties of the SmCo films which seems to be due to a formation of magnetically hard minor phases in droplet of Sm-rich intermetallics. However, the resultant rough surface of the SmCo films is a problem to be solved by a continued study.

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CoMFA vs. Topomer CoMFA, which One is better a Case Study with 5-Lipoxygenase Inhibitors

  • Gadhe, Changdev G.
    • Journal of Integrative Natural Science
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    • v.4 no.2
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    • pp.91-98
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    • 2011
  • Quantitative structure-activity relationships (QSAR) have been applied for two decades in the development of relationships between physicochemical properties of chemical substances and their biological activities to obtain a reliable statistical model for prediction of the activities of new chemical entities. The fundamental principle underlying the QSAR is that the structural difference is responsible for the variations in biological activities of the compounds. In this work, we developed 3D-QSAR model for a series of 5-Lipoxygenase inhibitors, utilizing comparative molecular field analysis (CoMFA) and Topomer CoMFA methodologies. Our developed models addressed superiority of Topomer CoMFA over CoMFA. The CoMFA model was obtained with $q^2$=0.593, $r^2$=0.939, $Q^2$=0.334 with 6 optimum number of components (ONC). Higher statistical results were obtained with the Topomer CoMFA model ($q^2$=0.819, $r^2$=0.947, ONC=5). Further robustness of developed models was checked with the ANOVA test and it shows F=113 for CoMFA and F=162.4 for Topomer CoMFA model. Contour map analysis indicated that the more requirement of electrostatic parameter for improved potency.