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DNA Oligonucleotide− cis -Platin Binding: Ab Initio Interpretation of the Vibrational Spectra

✍ Scribed by Andrushchenko, Valery; Wieser, Hal; Bouř, Petr


Book ID
127248264
Publisher
American Chemical Society
Year
2007
Tongue
English
Weight
487 KB
Volume
111
Category
Article
ISSN
1089-5639

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The results of the first calculations at the electron-correlated Møller-Plesset second-order perturbation theory (MP2) method on the vibrational infrared spectra are reported. The obtained spectra have been discussed and compared to those calculated at the density functional theory and Hartree-Fock