Theoretical Studies on Proteins to Reveal the Mechanism of Their Folding and Biological Functions
The folding mechanism of several β-structures (e.g., β-hairpins and β-sheets) was studied using newly developed enhanced sampling methods along with MD simulations in all implicit solvent environments. The influence of different implicit solvent models on the folding simulation of β-structure was al...
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| Format: | Others |
| Language: | en_US |
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2011
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| Online Access: | http://hdl.handle.net/1969.1/ETD-TAMU-2009-12-7395 |