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Protein Structure Prediction Volume 44 || Molecular Dynamics Simulations of Protein Folding

โœ Scribed by Zaki, Mohammed J.; Bystroff, Christopher


Book ID
111651228
Publisher
Humana Press
Year
2008
Weight
622 KB
Category
Article
ISBN
1597455741

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Computer simulations of protein folding
โœ Philippe Ferrara; Joannis Apostolakis; Amedeo Caflisch ๐Ÿ“‚ Article ๐Ÿ“… 2000 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 362 KB ๐Ÿ‘ 3 views

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