Author:
Valli Marilia,Russo Helena Mannochio,Pilon Alan Cesar,Pinto Meri Emili Ferreira,Dias Nathalia B.,Freire Rafael Teixeira,Castro-Gamboa Ian,Bolzani Vanderlan da Silva
Abstract
Abstract
Technological advances have contributed to the evolution of the natural product chemistry and drug discovery programs. Recently, computational methods for nuclear magnetic resonance (NMR) and mass spectrometry (MS) have speeded up and facilitated the process of structural elucidation even in high complex biological samples. In this chapter, the current computational tools related to NMR and MS databases and spectral similarity networks, as well as their applications on dereplication and determination of biological biomarkers, are addressed.
Subject
General Physics and Astronomy,General Materials Science,General Chemistry
Cited by
15 articles.
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