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Computer simulation of the binding of quinocarcin to DNA. Prediction of mode of action and absolute configuration

โœ Scribed by G. Craig Hill; Timothy P. Wunz; William A. Remers


Publisher
Springer Netherlands
Year
1988
Tongue
English
Weight
797 KB
Volume
2
Category
Article
ISSN
0920-654X

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โœ Soaring Bear; William A. Remers ๐Ÿ“‚ Article ๐Ÿ“… 1996 ๐Ÿ› Springer Netherlands ๐ŸŒ English โš– 942 KB

Intercalative binding of the antitumor drugs amonafide and azonafide to the oligonucleotide duplex d(GGCCGGCCGG).d(CCGGCCGGCC) was compared using molecular dynamics in vacuum with the AMBER force field. A number of reasonable possible binding conformations were obtained, with the azonafide complexes