A Hierarchy of Methods for the Energetically Accurate Modeling of Isomerism in Monosaccharides
Author:
Affiliation:
1. Institut Català d’Investigació Química, Av. Països Catalans 16, 43007 Tarragona, Spain
2. Max-Planck-Institut für Bioanorganische Chemie, Stiftstrasse 34-36, 45470 Mülheim an der Ruhr, Germany
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct3002305
Reference160 articles.
1. Carbohydrate Polymers at the Center of Life’s Origins: The Importance of Molecular Processivity
2. Carbohydrates—The Renewable Raw Materials of High Biotechnological Value
3. Robyt, J. F.Essentials of Carbohydrate Chemistry;Springer:Dordrecht, The Netherlands, 1997; p414.
4. Rao, V. S. R.; Qasba, P. K.; Balaji, P. V.; Chandrasekaran, R.Conformation of Carbohydrates;Harwood Academic Publishers:Amsterdam, 1998; p409.
5. Carbohydrates: Structures, Syntheses and Dynamics;Finch, P., Ed.Kluwer Academic Publishers:Dordrecht, The Netherlands, 1999, p352.
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