Article ID Journal Published Year Pages File Type
5389506 Chemical Physics Letters 2007 5 Pages PDF
Abstract
We integrated the ONIOM method with the molecular dynamics (MD) method and implemented it into the Hondo program for biochemical applications. In this first application of the ONIOM-MD method to cytidine deaminase, we examined the environmental effects of the pocket of the active site on the substrate.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
The ONIOM molecular dynamics method for biochemical applications: Cytidine deaminase
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