David S. Wishart

Research interests

Publications

• MetaboAnalyst 6.0: towards a unified platform for metabolomics data processing, analysis and interpretation

  Nucleic Acids Research · 2024 · 10.1093/nar/gkae253

• DrugBank 6.0: the DrugBank Knowledgebase for 2024

  Nucleic Acids Research · 2023 · 10.1093/nar/gkad976

• HMDB 5.0: the Human Metabolome Database for 2022

  Nucleic Acids Research · 2021 · https://doi.org/10.1093/nar/gkab1062

• Using MetaboAnalyst 4.0 for Comprehensive and Integrative Metabolomics Data Analysis

  Current Protocols in Bioinformatics · 2019 · 10.1002/cpbi.86

• MetaboAnalyst 4.0: towards more transparent and integrative metabolomics analysis

  Nucleic Acids Research · 2018 · https://doi.org/10.1093/nar/gky310

• DrugBank 5.0: a major update to the DrugBank database for 2018

  Nucleic Acids Research · 2017 · https://doi.org/10.1093/nar/gkx1037

• HMDB 4.0: the human metabolome database for 2018

  Nucleic Acids Research · 2017 · https://doi.org/10.1093/nar/gkx1089

• ClassyFire: automated chemical classification with a comprehensive, computable taxonomy

  Journal of Cheminformatics · 2016 · 10.1186/s13321-016-0174-y

• Metabolomics enables precision medicine: “A White Paper, Community Perspective”

  Metabolomics · 2016 · https://doi.org/10.1007/s11306-016-1094-6

• PHASTER: a better, faster version of the PHAST phage search tool

  Nucleic Acids Research · 2016 · https://doi.org/10.1093/nar/gkw387

• Heatmapper: web-enabled heat mapping for all

  Nucleic Acids Research · 2016 · 10.1093/nar/gkw419

• MetaboAnalyst 3.0—making metabolomics more meaningful

  Nucleic Acids Research · 2015 · 10.1093/nar/gkv380

• DrugBank 4.0: shedding new light on drug metabolism

  Nucleic Acids Research · 2013 · 10.1093/nar/gkt1068

• HMDB 3.0—The Human Metabolome Database in 2013

  Nucleic Acids Research · 2012 · 10.1093/nar/gks1065

• PHAST: A Fast Phage Search Tool

  Nucleic Acids Research · 2011 · 10.1093/nar/gkr485

• The Human Serum Metabolome

  PLoS ONE · 2011 · 10.1371/journal.pone.0016957

• DrugBank 3.0: a comprehensive resource for 'Omics' research on drugs

  Nucleic Acids Research · 2010 · 10.1093/nar/gkq1126

• MetaboAnalyst: a web server for metabolomic data analysis and interpretation

  Nucleic Acids Research · 2009 · 10.1093/nar/gkp356

• HMDB: a knowledgebase for the human metabolome

  Nucleic Acids Research · 2008 · 10.1093/nar/gkn810

• HMDB: the Human Metabolome Database

  Nucleic Acids Research · 2007 · 10.1093/nar/gkl923

• DrugBank: a knowledgebase for drugs, drug actions and drug targets

  Nucleic Acids Research · 2007 · 10.1093/nar/gkm958

• DrugBank: a comprehensive resource for in silico drug discovery and exploration

  Nucleic Acids Research · 2005 · https://doi.org/10.1093/nar/gkj067

• 1H, 13C and 15N chemical shift referencing in biomolecular NMR

  Journal of Biomolecular NMR · 1995 · 10.1007/bf00211777

• The 13C Chemical-Shift Index: A simple method for the identification of protein secondary structure using 13C chemical-shift data

  Journal of Biomolecular NMR · 1994 · 10.1007/bf00175245

• The chemical shift index: a fast and simple method for the assignment of protein secondary structure through NMR spectroscopy

  Biochemistry · 1992 · 10.1021/bi00121a010

• Relationship between nuclear magnetic resonance chemical shift and protein secondary structure

  Journal of Molecular Biology · 1991 · 10.1016/0022-2836(91)90214-q

Current projects

No projects listed.