Stability Order of Basic Peptide Conformations Reflected by Density Functional Theory

• 26 February 1998
• journal article
• research article
• Published by Springer Nature in Journal of Molecular Modeling
• Vol. 4  (2) , 53-60
• https://doi.org/10.1007/s008940050131

Abstract

Keywords

• KEYWORDS PEPTIDE SECONDARY STRUCTURE
• AB INITIO
• DENSITY FUNCTIONAL THEORY (DFT)
• HYDROGEN BONDS
• CORRELATION ENERGY
• GIBBS FREE ENERGY