(Q102369470)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

title

Systematic classification of unknown metabolites using high-resolution fragmentation mass spectra (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

1

1 reference

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27 November 2020

Louis-Félix Nothias

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

Markus Fleischauer

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

Raphael Reher

4

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

Marcus Ludwig

5

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

Martin A Hoffmann

6

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

Juho Rousu

9

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

Sebastian Böcker

11

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

10

Pieter C Dorrestein

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

7

Daniel Petras

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

8

William H Gerwick

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

publication date

23 November 2020

1 reference

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27 November 2020

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

MassBank: a public repository for sharing mass spectral data for life sciences

27 November 2020

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7 January 2021

Competitive fragmentation modeling of ESI-MS/MS spectra for putative metabolite identification

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7 January 2021

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7 January 2021

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7 January 2021

Automatic chemical structure annotation of an LC-MS(n) based metabolic profile from green tea.

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7 January 2021

MetFrag relaunched: incorporating strategies beyond in silico fragmentation

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7 January 2021

Hydrogen Rearrangement Rules: Computational MS/MS Fragmentation and Structure Elucidation Using MS-FINDER Software

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7 January 2021

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7 January 2021

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7 January 2021

Illuminating the dark matter in metabolomics

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7 January 2021

Advances in computational metabolomics and databases deepen the understanding of metabolisms.

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7 January 2021

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7 January 2021

Mass spectral databases for LC/MS- and GC/MS-based metabolomics: State of the field and future prospects

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7 January 2021

Global chemical analysis of biology by mass spectrometry

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7 January 2021

Mind the Gap: Mapping Mass Spectral Databases in Genome-Scale Metabolic Networks Reveals Poorly Covered Areas

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7 January 2021

Metabolite identification and molecular fingerprint prediction through machine learning.

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7 January 2021

The ChEBI reference database and ontology for biologically relevant chemistry: enhancements for 2013

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7 January 2021

ClassyFire: automated chemical classification with a comprehensive, computable taxonomy

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7 January 2021

Structure Annotation of All Mass Spectra in Untargeted Metabolomics

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7 January 2021

Assessing Specialized Metabolite Diversity in the Cosmopolitan Plant Genus Euphorbia L

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7 January 2021

A cheminformatics approach to characterize metabolomes in stable-isotope-labeled organisms

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7 January 2021

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7 January 2021

Identifying the Unknowns by Aligning Fragmentation Trees

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7 January 2021

Discovering Regulated Metabolite Families in Untargeted Metabolomics Studies.

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7 January 2021

MolNetEnhancer: Enhanced Molecular Networks by Integrating Metabolome Mining and Annotation Tools

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7 January 2021

ARISTO: ontological classification of small molecules by electron ionization-mass spectrometry

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7 January 2021

Chemical Diversity and Classification of Secondary Metabolites in Nine Bryophyte Species

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7 January 2021

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7 January 2021

Comparison of the predicted and observed secondary structure of T4 phage lysozyme

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7 January 2021

In silico fragmentation for computer assisted identification of metabolite mass spectra

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7 January 2021

SIRIUS 4: a rapid tool for turning tandem mass spectra into metabolite structure information

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7 January 2021

Hybrid Search: A Method for Identifying Metabolites Absent from Tandem Mass Spectrometry Libraries

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7 January 2021

Integration of Molecular Networking and In-Silico MS/MS Fragmentation for Natural Products Dereplication.

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7 January 2021

Propagating annotations of molecular networks using in silico fragmentation.

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7 January 2021

CANPA: Computer-Assisted Natural Products Anticipation

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7 January 2021

Global chemical effects of the microbiome include new bile-acid conjugations

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7 January 2021

Production of equol from daidzein by gram-positive rod-shaped bacterium isolated from rat intestine

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7 January 2021

Molecular Networking As a Drug Discovery, Drug Metabolism, and Precision Medicine Strategy

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7 January 2021

Cytoscape: a software environment for integrated models of biomolecular interaction networks

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7 January 2021

Topic modeling for untargeted substructure exploration in metabolomics

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7 January 2021

Euphorbia diterpenes: isolation, structure, biological activity, and synthesis (2008-2012).

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7 January 2021

A worldwide molecular phylogeny and classification of the leafy spurges, Euphorbia subgenus Esula (Euphorbiaceae)

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7 January 2021

Evolutionary bursts in Euphorbia (Euphorbiaceae) are linked with photosynthetic pathway.

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7 January 2021

A molecular phylogeny and classification of the largely succulent and mainly African Euphorbia subg. Athymalus (Euphorbiaceae)

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7 January 2021

Phylogenetics, morphological evolution, and classification of Euphorbia subgenus Euphorbia

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7 January 2021

Molecular phylogenetics and classification of Euphorbia subgenus Chamaesyce (Euphorbiaceae)

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7 January 2021

MZmine 2: modular framework for processing, visualizing, and analyzing mass spectrometry-based molecular profile data

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7 January 2021

Feature-based molecular networking in the GNPS analysis environment

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7 January 2021

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7 January 2021

XCMS2: processing tandem mass spectrometry data for metabolite identification and structural characterization

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7 January 2021

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7 January 2021

The KEGG databases at GenomeNet

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7 January 2021

Automated compound classification using a chemical ontology

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7 January 2021

Chemical substructures that enrich for biological activity

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7 January 2021

Extended-connectivity fingerprints

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7 January 2021

The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

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7 January 2021

PubChem chemical structure standardization

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7 January 2021

A Computer Program for Classifying Plants

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7 January 2021

Fragmentation trees reloaded

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7 January 2021

Combining Fragment-Ion and Neutral-Loss Matching during Mass Spectral Library Searching: A New General Purpose Algorithm Applicable to Illicit Drug Identification

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7 January 2021

On a Test of Whether one of Two Random Variables is Stochastically Larger than the Other

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7 January 2021

SciPy 1.0: fundamental algorithms for scientific computing in Python

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7 January 2021

Phylogenetics and the evolution of major structural characters in the giant genus Euphorbia L. (Euphorbiaceae).

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5 May 2024

https://opencitations.net/index/api/v1/references/10.1038/S41587-020-0740-8

MSnet: A Neural Network which Classifies Mass Spectra

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5 May 2024

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Database-independent molecular formula annotation using Gibbs sampling through ZODIAC

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5 May 2024

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5 May 2024

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Identifiers

DOI

10.1038/S41587-020-0740-8

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:33230292%20AND%20SRC:MED&resulttype=core&format=json

27 November 2020

1 reference