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Effect of methylation on the stability and solvation free energy of amylose and cellulose fragments: a molecular dynamics study

✍ Scribed by Haibo Yu; Manfred Amann; Tomas Hansson; Jutta Köhler; Günter Wich; Wilfred F. van Gunsteren


Book ID
108080142
Publisher
Elsevier Science
Year
2004
Tongue
English
Weight
1012 KB
Volume
339
Category
Article
ISSN
0008-6215

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## Abstract To investigate the relationship between structural change and the solvation effect, we estimated the solvation free energy or excess chemical potential (ECP) of a globular protein by the energy representation method for the protein structure obtained by a molecular dynamic simulation. A