We present the results of free energy perturbation/molecular dynamics studies on 3-DNA . daunomycin and 3-DNA . 9-aminoacridine complexes as well as on B-DNA itself in order to calculate the free energy differences between complexes having different base pair sequences. The results generally reprodu
โฆ LIBER โฆ
On the Molecular Mechanism of Drug Intercalation into DNA: A Simulation Study of the Intercalation Pathway, Free Energy, and DNA Structural Changes
โ Scribed by Mukherjee, Arnab; Lavery, Richard; Bagchi, Biman; Hynes, James T.
- Book ID
- 115548800
- Publisher
- American Chemical Society
- Year
- 2008
- Tongue
- English
- Weight
- 729 KB
- Volume
- 130
- Category
- Article
- ISSN
- 0002-7863
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