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Targeted Molecular Dynamics Simulations of Protein Unfolding

โœ Scribed by Ferrara, Philippe; Apostolakis, Joannis; Caflisch, Amedeo

Book ID
120367620
Publisher
American Chemical Society
Year
2000
Tongue
English
Weight
289 KB
Volume
104
Category
Article
ISSN
0022-3654

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๐Ÿ“œ SIMILAR VOLUMES

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We have performed 128 folding and 45 unfolding molecular dynamics runs of chymotrypsin inhibitor 2 (CI2) with an implicit solvation model for a total simulation time of 0.4 microseconds. Folding requires that the three-dimensional structure of the native state is known. It was simulated at 300 K by