Conformational energies of DNA sugar-phosphate backbone: Reference QM calculations and a comparison with density functional theory and molecular mechanics

Mládek, A., Šponer, J. E., Jurečka, P., Banáš, P., Otyepka, M., Svozil, D., Šponer, J. Conformational energies of DNA sugar-phosphate backbone: Reference QM calculations and a comparison with density functional theory and molecular mechanics. Journal of Chemical Theory and Computation. 2010, 6(12), 3817-3835. ISSN 1549-9618. E-ISSN 1549-9626. Dostupné z: doi: 10.1021/ct1004593