Search Result "replica-exchange MD simulations"


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

Generalized-Ensemble Algorithms for Protein Folding and Unfolding

Journal: Current Physical Chemistry
Volume: 2 Issue: 1 Year: 2012 Page: 92-106
Author(s): Yuko Okamoto

Investigation Binding Patterns of Human Carboxylesterase I (hCES I) with Broad Substrates by MD Simulations

Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 1 Year: 2013 Page: 1222-1233
Author(s): Huiying Chu, Hanyi Min, Mingbo Zhang, Hujun Shen, Guohui Li

Review Article

The Application of MD Simulation to Lead Identification, Vaccine Design,and Structural Studies in Combat against Leishmaniasis - A Review

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 24 Issue: 11 Year: 2024 Page: 1089-1111
Author(s): Lukkani Laxman Kumar

Review Article

Molecular Mechanism of Tau Misfolding and Aggregation: Insightsfrom Molecular Dynamics Simulation

Journal: Current Medicinal Chemistry
Volume: 31 Issue: 20 Year: 2024 Page: 2855-2871
Author(s):

Molecular Dynamics Simulation of MNT

Ebook: Micro and Nanomachining Technology-Size, Model and Complex Mechanism
Volume: 1 Year: 2014
Author(s): Xuesong Han
Doi: 10.2174/9781608057696114010005

Computer Simulations of Alzheimers Amyloid β-Protein Folding and Assembly

Journal: Current Alzheimer Research
Volume: 3 Issue: 5 Year: 2006 Page: 493-504
Author(s): Brigita Urbanc, Luis Cruz, David B. Teplow, H. Eugene Stanley

Recent Advances in Computational Simulations of Lipid Bilayer Based Molecular Systems

Ebook: Frontiers in Computational Chemistry
Volume: 2 Year: 2015
Author(s): R. Galeazzi,E. Laudadio,L. Massaccesi
Doi: 10.2174/9781608059782115020010

Antimicrobial and Cell-Penetrating Peptides: Structure, Assembly and Mechanisms of Membrane Lysis via Atomistic and Coarse-Grained Molecular Dynamic Simulations

Journal: Protein & Peptide Letters
Volume: 17 Issue: 1 Year: 2010 Page: 1313-1327
Author(s): Peter J. Bond, Syma Khalid

Review Article

Molecular Dynamics Simulations, Challenges and Opportunities: A Biologist’s Prospective

Journal: Current Protein & Peptide Science
Volume: 18 Issue: 11 Year: 2017 Page: 1163-1179
Author(s): Indu Kumari,Padmani Sandhu,Mushtaq Ahmed,Yusuf Akhter

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