The conformational space of 1C4 α-L-fucose was searched by the MM2 *-SUMM molecular mechanics conformational search technique. The molecular geometries of the first 17 structures of lowest energy were analyzed at the HF/3-21G, 6-31G(d) and generalized gradient approximation (GGA) DFT levels of theory.
|Number of pages||13|
|Journal||Journal of Computational Chemistry|
|Publication status||Published - Feb 1 1997|
ASJC Scopus subject areas
- Computational Mathematics