• Bulletin of the Korean Chemical Society
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• 제34권12호
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• pp.3727-3732
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• 2013

The interaction between metalloporphyrins and diazine tautomers was investigated using quantum chemistry method. The results showed that the metal atom in the metalloporphyrin was not coplanar with porphin ring, and zinc porphyrin has the most extent of its non-coplanar nature. The most stable complex in nine complexes was iron porphyrin. NBO analysis indicated that the interaction between the lone pair of electrons on the nitrogen atom and the unoccupied lone pair orbital of metal contributes significantly to the stability of the complexes. Through the conceptual DFT parameter and Fukui dual descriptor, the thermodynamic stability and reactivity of complexes were analyzed. The density difference function (DDF) analyzes were performed to explore the rearrangement of electronic density after the coordination interaction. NICS calculation indicated that metalloporphyrin aromaticity was reduced after the coordination interaction, and aromaticity of diazine tautomer was increased along direction vector of the coordination interaction force.

• 천문학회보
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• 제38권2호
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• pp.50.1-50.1
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• 2013

Blue Compact Dwarf galaxies (BCDs) are systems which have been experiencing the bursts of star formation in their central region. As one of the origins of active star formation, tidal interaction (merger or fly-by between dwarf galaxies) has been suggested. A pair of BCDs, ESO 435-IG20 and ESO 435-IG16, are suspected to be a good example of such case. They are located at a similar redshift and separated only by ~130 kpc at their distances. In addition a bridge-like HI structure has been found between these two BCDs in the HIPASS survey. In this study, using the ATCA HI data of a much better resolution, we probe the gas morphology and kinematics of individual galaxies. We discuss how tidal interaction is responsible for the high star formation rate in this BCD pair.

• 한국소음진동공학회:학술대회논문집
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• 한국소음진동공학회 2003년도 추계학술대회논문집
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• pp.778-783
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• 2003

The problem considered in this paper is about the collocation of sensor and actuator for the active control of sound and vibration. It is well-known that a point collocated sensor-actuator pair offers an unconditional stability with very high performance when it is used with a direct velocity feedback (DVFB) control, because the pair has strictly positive real (SPR) property. In order to utilize this SPR characteristics, a matched piezoelectric sensor and actuator pair is considered, but this pair suffers from the in-plane motion coupling problem with the out-of$.$plane motion due to the piezo sensor and actuator interaction. This coupling phnomenon limits the stability and performance of the matched pair with DVFB control. As a new alternative, a point sensor and piezoelectric actuator pair is also considered, which provides SPR property in all frequency range except at the first resonance in very low frequency. This non-SPR resonance could be minimized by applying a phase lag compensator.

• 생명과학회지
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• 제12권2호
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• pp.208-212
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• 2002

온도 기울기 전기영동장치를 이용하여 d(CXG)와 d(GXC) 염기의 열 안정성을 결정하는데 사람의 $\varepsilon$-글로빈 DNA조각을 사용하였다. 염기 쌍의 안정성은 이웃하는 염기서열에 의한 수소결합과 base stocking 상호작용에 의존한다. 염기 쌍의 안정성은 d(CXG) d(CYG)의 경우에 T.AG.A = A.G>C.T>T.C>C.A>A.C이다.

• 한국분무공학회지
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• 제10권4호
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• pp.26-31
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• 2005

Today, the research to examine a fact that interaction between the air and the fluid free surface affects the steady state flow and air. We proved the interaction between vortex pairs and free surface on each condition that is created by the end of delta wings. Another purpose of this study is to investigate the effect of surface active material which call change the surface tension and we must consider when we refer to turbulent flow on surface tension. Therefore, this research examined the growth process of vortex pairs on condition of clean, contaminated free surface and wall after we made vortex pairs through counter rotating flaps. The results of this study suggest that vortex pairs in clean free surface rise safely but the vortex pairs in contaminated free surface and rigid, no slip is made secondary vortex or rebounding. However the secondary vortex in rigid, no slip is stronger than before. and we can find the vortex shape which roll up more completely. However, these will disappear by the effect of wall.

• 한국소음진동공학회논문집
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• 제14권3호
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• pp.253-263
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• 2004

The problem considered in this paper is about the collocation of sensor and actuator for the active control of sound and vibration. It is well-known that a point collocated sensor-actuator pair offers an unconditional stability with very high performance when it is used with a direct velocity feedback (DVFB) control, because the pair has strictly positive real (SPR) property. In order to utilize this SPR characteristics, a matched piezoelectric sensor and actuator pair is considered. but this pair suffers from the in-plane motion coupling problem with the out-of-plane motion due to the piezo sensor and actuator interaction. This coupling phnomenon limits the stability and performance of the matched pair with DVFBcontrol. As a new alternative, a point sensor and distributed piezoelectric actuator pair is also considered, which provides SPR property in all frequency range when the pair is implemented on a clamped-clapmed beam. The use of this sensor-actuator pair is highly expected for the applications to more practical active control of sound and vibration systems with the DVFB control strategy.

• 한국정보과학회논문지:컴퓨팅의 실제 및 레터
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• 제11권5호
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• pp.427-435
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• 2005

인터넷 상에 단백질 및 관련 데이터의 축적에 따라, 도메인에 기반하여 단백질의 상호작용을 계산적으로 예측하는 많은 기법들이 제안되었다. 그러나, 대부분의 기법들이 예측에서 낮은 정확도와 복수개의 단백질 쌍에 대한 상호작용 가능성들 간에 순위 정보를 제공하지 못하는 등의 한계로 인하여 실무 적용에 한계를 가지고 있다. 본 논문에서는 도메인 조합 기반 단백질 상호작용 예측 기법을 재평가하고 상호작용하는 것으로 예측되는 복수개의 단백질 쌍들에서 이들의 상호작용 가능성들 간에 순위를 부여하는 방법을 제시한다. 순위 부여 방법은 도메인 조합에 기반한 단백질 상호작용 예측 방법의 틀 내에서 확률 식을 고안하여 제시한다. 제시된 순위 부여 기법을 사용함으로써, 상호작용을 하는 것으로 예측된 단백질 쌍들간에 상호작용 가능성이 좀 더 높은 것을 구별해 낼 수 있다. 또한 순위 부여 기법의 검증 과정에서 학습에 사용된 단백질 집단의 PIP(Primary Interaction Probability)값과 일치된 PIP값을 가지는 단백질 쌍 그룹의 경우에는, 상호작용 확률과 예측 정확도 사이에 상관관계가 존재함을 확인할 수 있었다.

• 폴리머
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• 제24권6호
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• pp.802-809
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• 2000

Poly(L-glutamic acid) (PLGA)와 PVA 블렌드막을 제조한 후, ethanol 수용액중에서 막증의 polypeptide 사슬의 2차구조 전이거동에 미치는 용매조성 및 대이온종의 영향과 알칼리 금속 이온 (Li, na, K, Cs)에 대한 투과특성을 조사하였다. 막중 PLG 알칼리 금속염의 helix 형성거동에 있어 대이온 선택성은 Li>Na>K>Cs의 순으로 관찰되었고, 이와 같은 특이성은 탈용매화 에너지와 정전에너지의 감소에 따른 고분자 하전기와 대이온과의 contact ion-pair 형성에 의한 것으로 설명하였다. 또한 PLGA/PVA 블렌드막의 ethanol 수용액 중에서의 알칼리 금속이온의 투과거동을 살펴보면, ethanol 농도가 점차 증가함에 따라 K, Cs의 경우는 투고도가 증가한, Li, Na의 경우에는 감소하였다. K, Cs 이온의 경우 대이온과 염소이온간의 ion-pair (M$^{+}{\cdot}$Cl$^{-}$)형성에 의한 Donnan배제효과의 감소와 중성염 형태로의 분배량 증가때문인 것으로, Li, Na 이온의 경우 막중의 coil-helix 구조전이에 따른 자유체적의 감소와 고분자 하전기와의 상호작용이 증가하여 확산성이 크게 감소하였기 때문인 것으로 생각된다.

• Bulletin of the Korean Chemical Society
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• 제29권4호
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• pp.790-794
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• 2008

Nucleophilic addition reaction of benzenethiols (PhSH) to 1-(2-nitrovinyl) benzenes ($\beta$ NS) in the presence of triethylamine (TEA) has been studied in acetonitrile at 25 ${^{\circ}C}$. The rate is first order with respect to [PhSH], [TEA] and [$\beta$ NS]. The reaction is found to proceed with the formation of ion-pair between benzenethiol and TEA. A suitable mechanism with the formation of an adduct between ion-pair and substrate in a slow step followed by its rearrangement to 1,2-addition product in a fast step has been proposed and corresponding rate law derived. From the rate law, the rate constants for the interaction between ion-pair and $\beta$NS have been evaluated. Interestingly, in both para-substituted substrates and benzenethiols the rate increases with the electron-withdrawing power of the substituents. The positive sign of $\rho_x$ in benzenethiols has been explained. The magnitude of cross-interaction constant, $\rho_{xy}$ is small (0.08). The magnitude of the Hammett $\rho_x$ values is higher than that of the Bronsted, $\beta_x$ values for benzenethiols. The kinetic isotope effect, $k_H/k_D$, is found to be greater than unity. A suitable transition state with simultaneous formation of $C_\beta$ -H and $B_\alpha$ -S bonds involving the ion-pair and $\beta$NS in a single concerted step has been proposed to account for these observations.

• Fibers and Polymers
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• 제2권2호
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• pp.81-85
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• 2001

The effects of rate of phase separation to ester interchange reactions and the repulsive pair interaction energy on the phase behavior in a phase-separated immiscible polyester blend are investigated using a Monte Carlo simulation method. The time evolution of structure factor and the degree of randomness are monitored as a function of homogenization time. When the phase separation is dominant over ester interchange reactions, the domain size slowly increases with homogenization time. However, when the pair interaction becomes less repulsive, the domain size does not significantly change with homogenization time. On the other hand, when ester interchange reactions are dominant over the phase separation, the homogenization proceeds without a change in the domain size. The higher the extent of phase separation, the lower the increasing rate of the DR. However, when the phase separation is sufficiently dominant, the effect of the extent of phase separation on the increasing rate of the degree of randomness become less significant.