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Functional group and substructure searching as a tool in metabolomics

Functional group and substructure searching as a tool in metabolomics

http://www.wikidata.org/entity/Q28472062

about

FragmentStore--a comprehensive database of fragments linking metabolites, toxic molecules and drugs.Metabolome-scale prediction of intermediate compounds in multistep metabolic pathways with a recursive supervised approach.Development and in silico evaluation of large-scale metabolite identification methods using functional group detection for metabolomics.KCF-S: KEGG Chemical Function and Substructure for improved interpretability and prediction in chemical bioinformatics.Characterising Complex Enzyme Reaction Data.PIERO ontology for analysis of biochemical transformations: effective implementation of reaction information in the IUBMB enzyme list.Ion Mobility Spectrometry-Mass Spectrometry Coupled with Gas-Phase Hydrogen/Deuterium Exchange for Metabolomics Analyses.In silico identification of targets for a novel scaffold, 2-thiazolylimino-5-benzylidin-thiazolidin-4-one.

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P2860

Functional group and substructure searching as a tool in metabolomics

http://www.wikidata.org/entity/Q28472062

description

2008 nî lūn-bûn

@nan

2008 թուականի Փետրուարին հրատարակուած գիտական յօդուած

@hyw

2008 թվականի փետրվարին հրատարակված գիտական հոդված

@hy

2008年の論文

@ja

2008年論文

@yue

2008年論文

@zh-hant

2008年論文

@zh-hk

2008年論文

@zh-mo

2008年論文

@zh-tw

2008年论文

@wuu

name

Functional group and substructure searching as a tool in metabolomics

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Functional group and substructure searching as a tool in metabolomics

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Functional group and substructure searching as a tool in metabolomics

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type

label

Functional group and substructure searching as a tool in metabolomics

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Functional group and substructure searching as a tool in metabolomics

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Functional group and substructure searching as a tool in metabolomics

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prefLabel

Functional group and substructure searching as a tool in metabolomics

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Functional group and substructure searching as a tool in metabolomics

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Functional group and substructure searching as a tool in metabolomics

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Functional group and substructure searching as a tool in metabolomics

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Andrew G McDonald

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Keith F Tipton

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Masaaki Kotera

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Sinéad Boyce

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P2860

From genomics to chemical genomics: new developments in KEGG

The University of Minnesota Biocatalysis/Biodegradation Database: the first decade.

Description of several chemical structure file formats used by computer programs developed at Molecular Design Limited

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

Enhancement of the chemical semantic web through the use of InChI identifiers

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

How the WLN began in 1949 and how it might be in 1999

Specificity assay of serine proteinases by reverse-phase high-performance liquid chromatography analysis of competing oligopeptide substrate library.

InfVis--platform-independent visual data mining of multidimensional chemical data sets.

Pharmacophore features of potential drugs.

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