Theoretical investigation of normal to strong hydrogen bonds
SCIE
SCOPUS
- Title
- Theoretical investigation of normal to strong hydrogen bonds
- Authors
- Pak, C; Lee, HM; Kim, JC; Kim, D; Kim, KS
- Date Issued
- 2005-06
- Publisher
- SPRINGER/PLENUM PUBLISHERS
- Abstract
- We review our theoretical work done on a variety of different chemical systems, which show different H-bonding characteristics. The systems include water clusters, its interactions with polar molecules and pi-systems, organic nanotubes, enzymes, and ionophores/receptors. Special features of normal, short, short strong, and pi-type H-bonding interactions in these systems are discussed in terms of structures, interaction energies, and spectra.
- Keywords
- hydrogen bond; ab initio calculations; water; ionophore; enzyme; FACE AROMATIC INTERACTIONS; DENSITY-FUNCTIONAL THEORY; GAS CORRELATION-ENERGY; COMPARATIVE AB-INITIO; PI-H INTERACTION; EDGE-TO-FACE; WATER CLUSTERS; DELTA(5)-3-KETOSTEROID ISOMERASE; VIBRATIONAL-SPECTRA; CYCLIC WATER
- URI
- https://oasis.postech.ac.kr/handle/2014.oak/24501
- DOI
- 10.1007/S11224-005-4
- ISSN
- 1040-0400
- Article Type
- Article
- Citation
- STRUCTURAL CHEMISTRY, vol. 16, no. 3, page. 187 - 202, 2005-06
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- There are no files associated with this item.
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