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Computer Simulations of Globular Protein Folding and Tertiary Structure

✍ Scribed by Skolnick, J; Kolinski, A


Book ID
118040615
Publisher
Annual Reviews
Year
1989
Tongue
English
Weight
660 KB
Volume
40
Category
Article
ISSN
0066-426X

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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