Model calculation of the effect of hydration on the energy band structure of a nucleotide base stack
- 15 November 1982
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 77 (10), 5026-5029
- https://doi.org/10.1063/1.443728
Abstract
No abstract availableKeywords
This publication has 12 references indexed in Scilit:
- Simulations of the solvent structure for macromolecules. I. Solvation of B‐DNA double helix at T = 300 KBiopolymers, 1981
- Interaction of water with DNA single and double helix in the B conformationInternational Journal of Quantum Chemistry, 1979
- Interaction of Water with DNA Single‐Helix in the A ConformationBiopolymers, 1979
- Iso-energy contour maps for the interaction of water with DNA double helix in the B conformationChemical Physics Letters, 1979
- Investigation of the interaction between molecules at medium distances. III. SCF LCAO MO supermolecule, perturbational and MCF calculations for two andChemical Physics, 1978
- Analytical potentials from "ab initio" computations for the interaction between biomolecules. 2. Water with the four bases of DNAJournal of the American Chemical Society, 1977
- Investigation of the interaction between molecules at medium distances: II. Perturbational and MCF calculations with directly integrated potentials and in the monopole approximationChemical Physics, 1977
- Investigation of the interaction between molecules at medium distances: I. SCF LCAO MO supermolecule, perturbational and mutually consistent calculations for two interacting HF and CH2O moleculesChemical Physics, 1975
- Study of the Electronic Structure of Molecules. XIV. Point Charge Perturbation on Periodic SystemsThe Journal of Chemical Physics, 1971
- Least-squares refinement of the crystal and molecular structures of DNA and RNA from X-ray data and standard bond lengths and anglesActa Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 1969