Article ID Journal Published Year Pages File Type
5394516 Computational and Theoretical Chemistry 2012 6 Pages PDF
Abstract
► A computationally efficient strategy for description of metal-DNA complexes is set out. ► This is first validated against an X-ray structure of a cisplatin-DNA dimer complex. ► Various optimisation strategies are then tested against a cisplatin-DNA octamer NMR structure.
Keywords
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
QM/MM studies of cisplatin complexes with DNA dimer and octamer
Authors
, ,