An iterative extended H ckel calculation for some amino acids containing sulphur and selenium
- 1 January 1971
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 20 (1) , 31-40
- https://doi.org/10.1007/bf00529108
Abstract
No abstract availableKeywords
This publication has 16 references indexed in Scilit:
- Quantum mechanical approach to the conformational analysis of macromolecules in ground and excited statesBiopolymers, 1969
- Extended Hückel MO calculations of the conformation of several amino acidsTheoretical Chemistry Accounts, 1969
- The crystal and molecular structure of L-cysteineActa Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 1968
- Semiempirical Molecular Orbital Calculations. II. The Nonbonding Orbital, the Electronic Spectrum, and the Spin—Orbit Coupling in X2CO MoleculesThe Journal of Chemical Physics, 1966
- Semiempirical Molecular Orbital Calculations. I. The Electronic Structure of H2O and H2SThe Journal of Chemical Physics, 1966
- Valence orbital ionization potentials from atomic spectral dataTheoretical Chemistry Accounts, 1965
- An Extended Hückel Theory. I. HydrocarbonsThe Journal of Chemical Physics, 1963
- Atomic Screening Constants from SCF FunctionsThe Journal of Chemical Physics, 1963
- Electronic structure of the α-amino acids of proteinsBiochimica et Biophysica Acta, 1963
- The crystal structure of hexagonalL-cystineActa Crystallographica, 1959