相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Searching molecular structure databases with tandem mass spectra using CSI:FingerID
Kai Duehrkop et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2015)
Illuminating the dark matter in metabolomics
Ricardo R. da Silva et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2015)
Multilabel classification through random graph ensembles
Hongyu Su et al.
MACHINE LEARNING (2015)
Operator-valued kernel-based vector autoregressive models for network inference
Nehemy Lim et al.
MACHINE LEARNING (2015)
Competitive fragmentation modeling of ESI-MS/MS spectra for putative metabolite identification
Felicity Allen et al.
METABOLOMICS (2015)
MIDAS: A Database-Searching Algorithm for Metabolite Identification in Metabolomics
Yingfeng Wang et al.
ANALYTICAL CHEMISTRY (2014)
Metabolite identification through multiple kernel learning on fragmentation trees
Huibin Shen et al.
BIOINFORMATICS (2014)
CFM-ID: a web server for annotation, spectrum prediction and metabolite identification from tandem mass spectra
Felicity Allen et al.
NUCLEIC ACIDS RESEARCH (2014)
Automatic Chemical Structure Annotation of an LC-MSn Based Metabolic Profile from Green Tea
Lars Ridder et al.
ANALYTICAL CHEMISTRY (2013)
The ChEBI reference database and ontology for biologically relevant chemistry: enhancements for 2013
Janna Hastings et al.
NUCLEIC ACIDS RESEARCH (2013)
Metabolite Identification through Machine Learning - Tackling CASMI Challenge Using FingerID
Huibin Shen et al.
METABOLITES (2013)
Metabolite identification and molecular fingerprint prediction through machine learning
Markus Heinonen et al.
BIOINFORMATICS (2012)
In silico fragmentation for computer assisted identification of metabolite mass spectra
Sebastian Wolf et al.
BMC BIOINFORMATICS (2010)
MassBank: a public repository for sharing mass spectral data for life sciences
Hisayuki Horai et al.
JOURNAL OF MASS SPECTROMETRY (2010)
Towards de novo identification of metabolites by analyzing tandem mass spectra
Sebastian Boecker et al.
BIOINFORMATICS (2008)
FiD:: a software for ab initio structural identification of product ions from tandem mass spectrometric data
Markus Heinonen et al.
RAPID COMMUNICATIONS IN MASS SPECTROMETRY (2008)
On learning vector-valued functions
CA Micchelli et al.
NEURAL COMPUTATION (2005)
Automated assignment of high-resolution collisionally activated dissociation mass spectra using a systematic bond disconnection approach
AW Hill et al.
RAPID COMMUNICATIONS IN MASS SPECTROMETRY (2005)