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New Features of Carbohydrate Structure Database Notation (CSDB Linear), As Compared to Other Carbohydrate Notations
- Source :
- Journal of Chemical Information and Modeling. 60:1276-1289
- Publication Year :
- 2019
- Publisher :
- American Chemical Society (ACS), 2019.
-
Abstract
- The CSDB Linear notation for carbohydrate sequences utilized in the Carbohydrate Structure Database (CSDB) has been improved to meet modern requirements in glycoinformatics. The new features include: the possibility to combine repeating and nonrepeating moieties in one structure; support of carbon-carbon bonds; and usage of SMILES encodings for unambiguous chemical description of glycan structures, including aglycons and atypical components. The new capabilities of CSDB Linear, together with the older ones, allow efficient detection of errors in CSDB and, at the same time, ensure the absence of informatic problems common for human-readable notations. The CSDB Linear implementation provides translation to other carbohydrate notations and multiple procedures for content error checking.
- Subjects :
- Thesaurus (information retrieval)
Informatics
010304 chemical physics
Database
Computer science
General Chemical Engineering
Carbohydrates
General Chemistry
Library and Information Sciences
computer.software_genre
Notation
01 natural sciences
0104 chemical sciences
Computer Science Applications
010404 medicinal & biomolecular chemistry
Carbohydrate Sequence
Polysaccharides
0103 physical sciences
Humans
Glycoinformatics
Carbohydrate composition
computer
Subjects
Details
- ISSN :
- 1549960X and 15499596
- Volume :
- 60
- Database :
- OpenAIRE
- Journal :
- Journal of Chemical Information and Modeling
- Accession number :
- edsair.doi.dedup.....f2fd4e799c6f23b68c2f813b21bfbc25
- Full Text :
- https://doi.org/10.1021/acs.jcim.9b00744