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The molecular electrostatic potential and steric accessibility of poly (dA-dT). poly (dA-dT) in various conformations: B-DNA, D-DNA and 'alternating-B' DNA.

Archive ouverte | Lavery, R. | CCSD

International audience. The influence of conformational changes on the molecular electrostatic potential and the steric accessibility of the double stranded polynucleotide poly (dA-dT). poly (dA-dT) are investigated...

A theoretical study of the sequence specificity in binding of lexitropsins to B-DNA.

Archive ouverte | Zakrzewska, K. | CCSD

International audience. A theoretical study is presented on the binding to B-DNA of a series of lexitropsins, these ligands being netropsin derivatives in which one or both of the pyrrole rings have been replaced by...

The solvation contribution to the binding energy of DNA with non-intercalating antibiotics.

Archive ouverte | Zakrzewska, K. | CCSD

International audience. The influence of the solvent on the binding energies to DNA of six non-intercalating antibiotics - netropsin, distamycin-3, distamycin-2, SN 18071, berenil and stilbamidine - is evaluated by ...

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