Steered molecular dynamics (SMD), a computer simulation method for studying force-induced reactions in biopolymers, has been applied to investigate the response of protein domains to stretching apart of their terminal ends. The simulations mimic atomic force microscopy and optical tweezer experiment
β¦ LIBER β¦
Molecular Dynamics Simulated Unfolding of von Willebrand Factor A Domains by Force
β Scribed by Wei Chen; Jizhong Lou; Cheng Zhu
- Book ID
- 107620661
- Publisher
- Springer
- Year
- 2009
- Tongue
- English
- Weight
- 910 KB
- Volume
- 2
- Category
- Article
- ISSN
- 1865-5025
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## Abstract The conformational characteristics of glycosylatedβ and unglycosylated bovine pancreatic ribonuclease A (RNaseA) were traced with unfolding molecular dynamics simulations using CHARMM program at 470 K. The glycosylated RNase (Glc\_RNase) possesses nearly identical protein structure with