Computational Studies on Carbohydrates: I. Density Functional Ab Initio Geometry Optimization on Maltose Conformations

Journal of Computational Chemistry

Volumn 21, Issue 13, 2000, Pages 1204-1219

  Momany, F A ^a   Willett, J L ^a  

^a NATIONAL CENTER FOR AGRICULTURAL UTILIZATION RESEARCH   (United States)

Author keywords

Ab initio; Carbohydrates; Conformational analysis; Density functional; Geometry optimization; Maltose

Indexed keywords

EID: 0000497293     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/1096-987X(200010)21:13<1204::AID-JCC9>3.0.CO;2-F     Document Type: Article

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