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Structure Determination of Syndecan-4 Transmembrane Domain using PISA Wheel Pattern and Molecular Dynamics simulation
Choi. Sung-Sub, Jeong. Ji-Ho, Kim. Ji-Sun, Kim. Yongae 한국자기공명학회 Journal of the Korean magnetic resonance society 5 Pages
한국자기공명학회 Journal of the Korean magnetic resonance society 2014, Vol.18 No.2 58-62 (5 pages)
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Characterization of Binding Mode of the Heterobiaryl gp120 Inhibitor in HIV-1 Entry: A Molecular Docking and Dynamics Simulation Study
Gadhe. Changdev G., Kothandan. Gugan, Cho. Seung Joo 대한화학회 Bulletin of the Korean Chemical Society 7 Pages
대한화학회 Bulletin of the Korean Chemical Society 2013, Vol.34 No.8 2466-2472 (7 pages)
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Molecular Dynamics Simulation Study for Ionic Strength Dependence of RNA-host factor Interaction in Staphylococcus aureus Hfq
Lazar. Prettina, Lee. Yun-O, Kim. Song-Mi, Chandrasekaran. Meganathan, Lee. Keun-Woo 대한화학회 Bulletin of the Korean Chemical Society 8 Pages
대한화학회 Bulletin of the Korean Chemical Society 2010, Vol.31 No.6 1519-1526 (8 pages)
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Molecular Dynamics Simulation and Density Functional Theory Investigation for Thiacalix[4]biscrown and its Complexes with Alkali-Metal Cations
Hong. Joo-Yeon, Lee. Che-Wook, Ham. Si-Hyun 대한화학회 Bulletin of the Korean Chemical Society 4 Pages
대한화학회 Bulletin of the Korean Chemical Society 2010, Vol.31 No.2 453-456 (4 pages)
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Nonequilibrium Molecular Dynamics Simulation Study on the Shear-Induced Orientational Change of Rodlike Molecules
이창준, 심훈구, 김운천, 이송희, 박형숙, Lee. Chang Jun, Sim. Hun Gu, Kim. Un Cheon, Lee. Song Hui, Park. Hyeong Suk 대한화학회 Bulletin of the Korean Chemical Society 7 Pages
대한화학회 Bulletin of the Korean Chemical Society 2000, Vol.21 No.4 434-440 (7 pages)
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Molecular Dynamics Simulation Studies of Zeolite-A. Ⅱ. Structure and Dynamics of Cations in Dehydrated $Ca^{2+}$-Exchanged Zeolite-A
Moon. Gyeong Keun, Choi. Sang Gu, Kim. Han Soo, Lee. Song Hi 대한화학회 Bulletin of the Korean Chemical Society 7 Pages
대한화학회 Bulletin of the Korean Chemical Society 1993, Vol.14 No.3 356-362 (7 pages)
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Molecular Dynamics Simulation Studies of Zeolite-A. Ⅰ. Structure and Dynamics of $Na^+$ Ions in Rigid Dehydrated Zeolite-A Framework
Moon. Gyeong Keun, Choi. Sang Gu, Kim. Han Soo, Lee. Song Hi 대한화학회 Bulletin of the Korean Chemical Society 8 Pages
대한화학회 Bulletin of the Korean Chemical Society 1992, Vol.13 No.3 317-324 (8 pages)
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A molecular dynamics simulation on the defect structure in silicon under indentation
트란딘 롱, 유용문, 강우종, 전성식, Trandinh. Long, Ryu. Yong-Moon, Kang. Woo-Jong, Cheon. Seong-Sik 한국복합재료학회 복합재료 : 한국복합재료학회지 5 Pages
한국복합재료학회 복합재료 : 한국복합재료학회지 2011, Vol.24 No.2 9-13 (5 pages)
본 논문에서는 zinc blende계열의 결정구조를 갖는 실리콘 내부의 결함을 분석할 수 있는 대칭축 파라메터 (Symmetric axis parameter)방법을 이용하여, 탄성 및 소성 변형을 구별하는 방법을 제시하였다. 분자 동력학 해석프로그램인 LAMMPS를 사용하여, 실리콘에 대한 나노인덴테이션 해석을 수행하였다. 구형 인덴터 아래에 발생한 실리콘내부의 결함은 ring crack에서의 threefold 무늬와 전위발생경로를 보여주였다. 또한, 해석결과는 기존의 이론이나, 실험결과와도 일치하는 것을 확인하였다. -
Pharmacophore Modeling and Molecular Dynamics Simulation to Find the Potent Leads for Aurora Kinase B
Sakkiah. Sugunadevi, Thangapandian. Sundarapandian, Kim. Yong-Seong, Lee. Keun-Woo 대한화학회 Bulletin of the Korean Chemical Society 12 Pages
대한화학회 Bulletin of the Korean Chemical Society 2012, Vol.33 No.3 869-880 (12 pages)
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On the Structural Stability of a Short Three Stranded β-sheet Peptide (Betanova): Replica Exchange Molecular Dynamics Simulation Study
Jang. Soon-Min, Kim. Eun-Ae, Pak. Young-Shang 대한화학회 Bulletin of the Korean Chemical Society 3 Pages
대한화학회 Bulletin of the Korean Chemical Society 2010, Vol.31 No.8 2386-2388 (3 pages)
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Accelerating Molecular Dynamics Simulation Using Graphics Processing Unit
Myung. Hun-Joo, Sakamaki. Ryuji, Oh. Kwang-Jin, Narumi. Tetsu, Yasuoka. Kenji, Lee. Sik 대한화학회 Bulletin of the Korean Chemical Society 5 Pages
대한화학회 Bulletin of the Korean Chemical Society 2010, Vol.31 No.12 3639-3643 (5 pages)
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Structural Basis of Functional Conversion of a Floral Repressor to an Activator: A Molecular Dynamics Simulation Study
Kang. Suk-Ki, Lee. Ju-Yong, Lee. Myeong-Sup, Seok. Cha-Ok 대한화학회 Bulletin of the Korean Chemical Society 5 Pages
대한화학회 Bulletin of the Korean Chemical Society 2008, Vol.29 No.2 408-412 (5 pages)
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Molecular Dynamics Simulation Study of Density Effects on Vibrational Dephasing in Diatomic Molecular Liquid $N_2$
Oh. Kwang-Jin, Jeon. Seung-Joon, Lee. Eok Kyun, Park. Tae Jun 대한화학회 Bulletin of the Korean Chemical Society 5 Pages
대한화학회 Bulletin of the Korean Chemical Society 1994, Vol.15 No.2 118-122 (5 pages)
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Molecular Dynamics Simulations of Nanomemory Element Based on Boron Nitride Nanotube-to-peapod Transition
Hwang. Ho Jung, Kang. Jeong Won, Byun. Ki Ryang 한국전기전자재료학회 Transactions on electrical and electronic materials 6 Pages
한국전기전자재료학회 Transactions on electrical and electronic materials 2004, Vol.5 No.6 227-232 (6 pages)
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Bioinformatics Analysis of SARS Proteins and Molecular Dynamics Simulated Structure of an Alpha-helix Motif
Reddy. Amarender D., Suh. Seung-Bum, Ghaffari. Reza, Singh.. N. Jiten, Kim. Dae-Jin, Han. Joon-Hee, Kim. Kwang S. 대한화학회 Bulletin of the Korean Chemical Society 2 Pages
대한화학회 Bulletin of the Korean Chemical Society 2003, Vol.24 No.7 899-900 (2 pages)
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Molecular Dynamics Simulations on Thermodynamic and Structural Properties of Benzene Derivatives 1 - The Shear Viscosity of Benzene and Toluene
김정림, 원영도, Kim. Jeong Rim, Won. Yeong Do 대한화학회 Bulletin of the Korean Chemical Society 2 Pages
대한화학회 Bulletin of the Korean Chemical Society 2001, Vol.22 No.12 1287-1288 (2 pages)
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In silico study on indole derivatives as anti HIV-1 agents: a combined docking, molecular dynamics and 3D-QSAR study
Balupuri. Anand, Gadhe. Changdev G., Balasubramanian. Pavithra K., Kothandan. Gugan, Cho. Seung Joo 대한약학회 Archives of pharmacal research : a publication of the Pharmaceutical Society of Korea 15 Pages
대한약학회 Archives of pharmacal research : a publication of the Pharmaceutical Society of Korea 2014, Vol.37 No.8 1001-1015 (15 pages)
