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Simulation of protein-folding pathways: lost in (conformational) space?

โœ Scribed by David A. Hinds; Michael Levitt


Book ID
114151974
Publisher
Elsevier Science
Year
1995
Tongue
English
Weight
589 KB
Volume
13
Category
Article
ISSN
0167-7799

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Protein folding simulation with solvent-
โœ Shoji Takada ๐Ÿ“‚ Article ๐Ÿ“… 2000 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 708 KB

We propose a coarse-grained model of proteins that take into account solvent effects and apply it for simulating folding of a three-helixbundle protein. The energy functional form, refined from our previous work (Takada et al., J Chem Phys 1999;110:11616 -11629), tries to closely imitate real physic