Advanced search
Start date
Betweenand
Related content
(Reference retrieved automatically from Web of Science through information on FAPESP grant and its corresponding number as mentioned in the publication by the authors.)

Computational methods for NMR and MS for structure elucidation II: database resources and advanced methods

Full text
Author(s):
Valli, Marilia [1] ; Russo, Helena Mannochio [1] ; Pilon, Alan Cesar [1, 2] ; Ferreira Pinto, Meri Emili [1] ; Dias, Nathalia B. [3] ; Freire, Rafael Teixeira [4] ; Castro-Gamboa, Ian [1] ; Bolzani, Vanderlan da Silva [1]
Total Authors: 8
Affiliation:
[1] Sao Paulo State Univ ESP, Inst Chem, Dept Organ Chem, Nuclei Bioassays Biosynth & Ecophysiol Nat Prod N, Av Prof Francisco Degni 55, Araraquara, SP - Brazil
[2] Univ Sao Paulo, Fac Pharmaceut Sci Ribeirao Preto, Dept Phys & Chem, Nucleus Res Nat Prod & Synthet, Ribeirao Preto - Brazil
[3] Sao Paulo State Univ ESP, Inst Biosci Rio Claro, Dept Biol CEIS, Av 24A 1515, Rio Claro, SP - Brazil
[4] Univ Greenwich UoG, Medway Metabon Res Grp, London - England
Total Affiliations: 4
Document type: Journal article
Source: PHYSICAL SCIENCES REVIEWS; v. 4, n. 11 NOV 2019.
Web of Science Citations: 1
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. (AU)

FAPESP's process: 16/13292-8 - Analysis of nitrogen content in antropic influenced areas in Amazon and Atlantic Forest using a metabolomic tools
Grantee:Alan Cesar Pilon
Support Opportunities: Scholarships in Brazil - Post-Doctoral
FAPESP's process: 17/17098-4 - Application of MALDI Imaging (MSI) on non-nodulated and nodulated leaves of Psychotria and Hybanthus: Localization, analysis of cyclotides and its relationship with endosymbionts bacteria
Grantee:Meri Emili Pinto Nascimento
Support Opportunities: Scholarships in Brazil - Post-Doctoral
FAPESP's process: 13/07600-3 - CIBFar - Center for Innovation in Biodiversity and Drug Discovery
Grantee:Glaucius Oliva
Support Opportunities: Research Grants - Research, Innovation and Dissemination Centers - RIDC
FAPESP's process: 14/50926-0 - INCT 2014: biodiversity and natural products
Grantee:Vanderlan da Silva Bolzani
Support Opportunities: BIOTA-FAPESP Program - Thematic Grants