G.A.M.E.: GPU-accelerated mixture elucidator

G.A.M.E.: GPU-accelerated mixture elucidator

Abstract GPU acceleration is useful in solving complex chemical information problems. Identifying unknown structures from the mass spectra of natural product mixtures has been a desirable yet unresolved issue in metabolomics. However, this elucidation process has been hampered by complex experimenta...

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Bibliographic Details
Main Authors: Alioune Schurz, Bo-Han Su, Yi-Shu Tu, Tony Tsung-Yu Lu, Olivia A. Lin, Yufeng J. Tseng
Format: Article
Language:English
Published: BMC 2017-09-01
Series:Journal of Cheminformatics
Subjects:
Natural product
Mass spectrum
Structure elucidator
GPU acceleration
Online Access:http://link.springer.com/article/10.1186/s13321-017-0238-7

Internet

http://link.springer.com/article/10.1186/s13321-017-0238-7

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