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Molecular dynamics and free energy of binding of oleic acid to DNA in aqueous solutions

โœ Scribed by D. S. Tarasov, M. Y. Ibragimova, E. D. Izotova, N. I. Akberova, R. I. Zhdanov

Book ID
118726116
Publisher
SP MAIK Nauka/Interperiodica
Year
2012
Tongue
English
Weight
506 KB
Volume
446
Category
Article
ISSN
1607-6729

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โœ Matteo Pappalardo; Danilo Milardi; Domenico M. Grasso; Carmelo La Rosa ๐Ÿ“‚ Article ๐Ÿ“… 2003 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 184 KB

## Abstract Free energy perturbation/molecular dynamics simulations have been carried out on copper/azurin systems calculating the binding affinities of copper (II) ion to azurin either in the native or in the unfolded state. In order to test the validity of the strategy adopted for the calculation