Search Result "Brownian dynamics simulations"


Review Article

Use of Molecular Dynamics Simulations in Structure-Based Drug Discovery

Journal: Current Pharmaceutical Design
Volume: 25 Issue: 31 Year: 2019 Page: 3339-3349
Author(s): Indrani Bera,Pavan V. Payghan

Molecular Simulation in Drug Design: An Overview of Molecular Dynamics Methods

Ebook: Applied Computer-Aided Drug Design: Models and Methods
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815179934123010009

Bridging the Gap Between Optical Spectroscopic Experiments and Computer Simulations for Fast Protein Folding Dynamics

Journal: Current Physical Chemistry
Volume: 2 Issue: 1 Year: 2012 Page: 45-58
Author(s): Raymond Z. Cui, Daniel-Adriano Silva, Jian Song, Gregory R. Bowman, Wei Zhuang, Xuhui Huang

Two-, Three-, and Four-State Events Occur in the Mechanical Unfolding of Small Protein L Using Molecular Dynamics Simulations

Journal: Protein & Peptide Letters
Volume: 17 Issue: 1 Year: 2010 Page: 92-103
Author(s): Anna V. Glyakina, Nikolay K. Balabaev, Oxana V. Galzitskaya

Simulating the Interactions of Toxins with K+ Channels

Journal: Current Pharmaceutical Design
Volume: 10 Issue: 9 Year: 2004 Page: 1057-1067
Author(s): Xiaoqin Huang, Hong Liu, Meng Cui, Wei Fu, Kunqian Yu, Kaixian Chen, Xiaomin Luo, Jianhua Shen, Hualiang Jiang

Low-Coherence Dynamic Light Scattering and its Potential for Measuring Cell Dynamics

Journal: Current Pharmaceutical Biotechnology
Volume: 13 Issue: 14 Year: 2012 Page: 2562-2568
Author(s): Katsuhiro Ishii,Toshiaki Iwai

Molecular Dynamics Simulations of Proteins and Peptides: From Folding to Drug Design

Journal: Current Protein & Peptide Science
Volume: 9 Issue: 2 Year: 2008 Page: 181-196
Author(s): Giulia Morra, Massimiliano Meli, Giorgio Colombo

Solvent Viscosity and Friction in Protein Folding Dynamics

Journal: Current Protein & Peptide Science
Volume: 11 Issue: 5 Year: 2010 Page: 385-395
Author(s): Stephen J. Hagen

Molecular Dynamics as a Tool in Rational Drug Design: Current Status and Some Major Applications

Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 4 Year: 2009 Page: 225-240
Author(s): Roberta Galeazzi

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

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