| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5381798 | Chemical Physics Letters | 2013 | 6 Pages |
Abstract
- The mechanical unfolding of a beta-hairpin is studied in presence of osmolytes.
- The study is performed via steered molecular dynamics and umbrella sampling.
- Analysing free energy profiles, osmoprotectants and denaturants effects are outlined.
- Structural insight about unfolding mechanism are disclosed.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Stefano Pieraccini, Simone Conti, Shilpi Chaurasia, Maurizio Sironi,