QM Computations on Complete Nucleic Acids Building Blocks: Analysis of the Sarcin-Ricin RNA Motif Using DFT-D3, HF-3c, PM6-D3H, and MM Approaches

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

Kruse, H; Havrila, M; Sponer, J, 2014: QM Computations on Complete Nucleic Acids Building Blocks: Analysis of the Sarcin-Ricin RNA Motif Using DFT-D3, HF-3c, PM6-D3H, and MM Approaches. JOURNAL OF CHEMICAL THEORY AND COMPUTATION 10(6), p. 2615 - 2629, doi: 10.1021/ct500183w