Search Result "Molecular Dynamics (MD) Simulation"


Molecular Dynamics Simulations of CYP2E1

Journal: Medicinal Chemistry
Volume: 8 Issue: 2 Year: 2012 Page: 208-221
Author(s): Jue Li, Dong-Qing Wei, Jing-Fang Wang, Zheng-Tian Yu, Kuo-Chen Chou

Functional Dynamics of Proteins Elucidated by Statistical Analysis of Simulation Data

Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 443-451
Author(s): Burak Alakent,Zeynep Kurkcuoglu,Pemra Doruker

Recent Progress in Molecular Dynamics Simulations of Dihydrofolate Reductase

Journal: Current Enzyme Inhibition
Volume: 8 Issue: 2 Year: 2012 Page: 140-149
Author(s): John E. Kerrigan,Emine Ercikan Abali,Joseph R. Bertino

Molecular Dynamics Simulations of Membrane Proteins: Building Starting Structures and Example Applications

Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 363-378
Author(s): Thomas H. Schmidt,Megan L. O'Mara,Christian Kandt

Molecular Dynamics of Protein Kinase-Inhibitor Complexes: A Valid Structural Information

Journal: Current Pharmaceutical Design
Volume: 18 Issue: 20 Year: 2012 Page: 2946-2963
Author(s): Julio Caballero,Jans H. Alzate-Morales

Study on Nanoimprint Formability Considering the Anti-adhesion Layer for (CH2)n Polymer by Molecular Dynamics Simulation

Journal: Current Nanoscience
Volume: 8 Issue: 3 Year: 2012 Page: 424-431
Author(s): Quang-Cherng Hsu,Yu-Ter Lin,Dun-Cin Chou,Cheng-Da Wu

A Closer Look into G Protein Coupled Receptor Activation: X-Ray Crystallography and Long-Scale Molecular Dynamics Simulations

Journal: Current Medicinal Chemistry
Volume: 19 Issue: 8 Year: 2012 Page: 1135-1145
Author(s): S. Vanni, U. Rothlisberger

Dynamics and Hydration of the Active Sites of Mammalian Cytochromes P450 Probed by Molecular Dynamics Simulations

Journal: Current Drug Metabolism
Volume: 13 Issue: 2 Year: 2012 Page: 177-189
Author(s): Tereza Hendrychova, Karel Berka, Veronika Navratilova, Pavel Anzenbacher, Michal Otyepka

Recent Applications of Replica-Exchange Molecular Dynamics Simulations of Biomolecules

Journal: Current Physical Chemistry
Volume: 2 Issue: 4 Year: 2012 Page: 401-412
Author(s): Yuji Sugita,Naoyuki Miyashita,Pai-Chi Li,Takao Yoda,Yuko Okamoto

Mechanical Properties of Graphene Nanobuds: A Molecular Dynamics Study

Journal: Current Nanoscience
Volume: 8 Issue: 1 Year: 2012 Page: 89-96
Author(s): Yongping Zheng, Lanqing Xu, Zheyong Fan, Ning Wei, Yu Lu, Zhigao Huang

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