
SCIENCE LINKS
Essential Databases for Your Research
Welcome to your one-stop hub for research databases and resources! Here, you’ll find curated links to the most reliable and cutting-edge scientific tools, journals, and platforms. Whether you’re conducting nanoscience experiments, exploring advanced spectroscopy techniques, or diving into data analysis, these resources are here to support your journey.
Journals Links (A-Z)
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Accounts of Chemical Research
https://pubs.acs.org/journal/achre4 -
ACS Catalysis
https://pubs.acs.org/journal/accacs -
ACS Central Science
https://pubs.acs.org/journal/acscii -
ACS Nano
https://pubs.acs.org/journal/ancac3 -
Advanced Energy Materials
https://onlinelibrary.wiley.com/journal/16146832 -
Advanced Functional Materials
https://onlinelibrary.wiley.com/journal/16163028 -
Advanced Materials
https://onlinelibrary.wiley.com/journal/15214095 -
Angewandte Chemie International Edition
https://onlinelibrary.wiley.com/journal/15213773 -
Analytical Chemistry
https://pubs.acs.org/journal/ancham -
Biochemistry
https://pubs.acs.org/journal/bichaw -
Biomacromolecules
https://pubs.acs.org/journal/bomaf6 -
Chemical Communications
https://pubs.rsc.org/en/journals/journal/cc -
Chemical Engineering Journal
https://www.journals.elsevier.com/chemical-engineering-journal -
Chemical Reviews
https://pubs.acs.org/journal/chreay -
Chemical Science
https://pubs.rsc.org/en/journals/journal/sc -
Chemical Society Reviews
https://pubs.rsc.org/en/journals/journal/cs -
Chemistry – A European Journal
https://chemistry-europe.onlinelibrary.wiley.com/journal/15213765 -
Chemistry of Materials
https://pubs.acs.org/journal/cmatex -
Coordination Chemistry Reviews
https://www.journals.elsevier.com/coordination-chemistry-reviews -
Energy & Environmental Science
https://pubs.rsc.org/en/journals/journal/ee -
Environmental Science & Technology
https://pubs.acs.org/journal/esthag -
Green Chemistry
https://pubs.rsc.org/en/journals/journal/gc -
Inorganic Chemistry
https://pubs.acs.org/journal/inocaj -
Journal of Agricultural and Food Chemistry
https://pubs.acs.org/journal/jafcau -
Journal of Analytical Atomic Spectrometry
https://pubs.rsc.org/en/journals/journal/ja -
Journal of Biological Chemistry
https://www.jbc.org/ -
Journal of Catalysis
https://www.journals.elsevier.com/journal-of-catalysis -
Journal of Chemical Education
https://pubs.acs.org/journal/jceda8 -
Journal of Materials Chemistry A
https://pubs.rsc.org/en/journals/journal/ta -
Journal of Materials Chemistry B
https://pubs.rsc.org/en/journals/journal/tb -
Journal of Materials Chemistry C
https://pubs.rsc.org/en/journals/journal/tc -
Journal of Medicinal Chemistry
https://pubs.acs.org/journal/jmcmar -
Journal of Organic Chemistry
https://pubs.acs.org/journal/joceah -
Journal of Physical Chemistry A
https://pubs.acs.org/journal/jpcafh -
Journal of Physical Chemistry B
https://pubs.acs.org/journal/jpcbfk -
Journal of Physical Chemistry C
https://pubs.acs.org/journal/jpccck -
Journal of the American Chemical Society (JACS)
https://pubs.acs.org/journal/jacsat -
Langmuir
https://pubs.acs.org/journal/langd5 -
Macromolecules
https://pubs.acs.org/journal/mamobx -
Nano Letters
https://pubs.acs.org/journal/nalefd -
Nature
https://www.nature.com/ -
Nature Chemistry
https://www.nature.com/nchem/ -
Nature Communications
https://www.nature.com/ncomms/ -
Nature Materials
https://www.nature.com/nmat/ -
Nature Reviews Chemistry
https://www.nature.com/natrevchem/ -
Nature Reviews Drug Discovery
https://www.nature.com/nrd/ -
Organic Letters
https://pubs.acs.org/journal/orlef7 -
Organometallics
https://pubs.acs.org/journal/orgnd7 -
Science
https://www.sciencemag.org/ -
Science Advances
https://advances.sciencemag.org/ -
Scientific Reports
https://www.nature.com/srep/ -
Soft Matter
https://pubs.rsc.org/en/journals/journal/sm -
Supramolecular Chemistry
https://www.tandfonline.com/toc/gsch20/current -
Sustainable Chemistry and Engineering
https://pubs.acs.org/journal/ascecg -
Trends in Chemistry
https://www.cell.com/trends/chemistry -
Water Research
https://www.journals.elsevier.com/water-research -
Chemical Biology & Drug Design
https://onlinelibrary.wiley.com/journal/17470285 -
Journal of Chemical Technology and Biotechnology
https://onlinelibrary.wiley.com/journal/10974660 -
Electrochimica Acta
https://www.journals.elsevier.com/electrochimica-acta -
Bioinorganic Chemistry and Applications
https://www.hindawi.com/journals/bca/
Reliable online tools and platforms for predicting and visualizing spectrometry data, including NMR, IR, UV-Vis, and mass spectrometry
NMR Prediction Tools
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NMRShiftDB
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Description: Predicts and visualizes ^1H and ^13C NMR spectra from molecular structures.
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Website: NMRShiftDB
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ACD/Labs NMR Predictor
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Description: A powerful tool for predicting and analyzing NMR spectra, available online and as desktop software.
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Website: ACD/Labs NMR Predictor
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Chemaxon MarvinSketch
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Description: Offers ^1H and ^13C NMR prediction for drawn structures. Free for academic use.
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Website: MarvinSketch
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Predict NMR Spectra (nmrdb.org)
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Description: Free tool for generating ^1H and ^13C NMR spectra based on a molecular structure.
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Website: nmrdb.org
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Mass Spectrometry Prediction Tools
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MassBank
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Description: A database of experimental mass spectra, useful for comparing and predicting MS data.
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Website: MassBank
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METLIN
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Description: A metabolomics database with predicted and experimental MS/MS spectra for thousands of compounds.
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Website: METLIN
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MS-Interpreter
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Description: Predicts fragmentation patterns and interprets mass spectra for molecules.
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Website: MS-Interpreter
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IR and UV-Vis Prediction Tools
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IR Spectrum Simulation (Gaussian WebMO)
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Description: Simulates IR spectra for chemical structures using quantum mechanics.
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Website: Gaussian WebMO
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SpectraBase
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Description: Offers a large database of IR, UV-Vis, MS, and NMR spectra for reference and comparison.
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Website: SpectraBase
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ChemDoodle Online
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Description: Provides free IR, UV-Vis, and NMR predictions for simple molecular structures.
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Website: ChemDoodle Online
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Integrated Spectrometry Tools
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Virtual Computational Chemistry Laboratory (VCCLAB)
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Description: Predicts NMR, IR, and UV-Vis spectra and other properties from molecular structures.
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Website: VCCLAB
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SciFinder
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Description: A comprehensive database for chemical data, including spectral predictions and experimental results.
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Website: SciFinder
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Nanomaterials Centers Worldwide
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Center for Nanoscale Systems (CNS)
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Institution: Harvard University, Cambridge, MA, USA
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Website: https://cns.harvard.edu/
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Cornell Nanoscale Science and Technology Facility (CNF)
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Institution: Cornell University, Ithaca, NY, USA
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Website: https://www.cnf.cornell.edu/
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Mid-Atlantic Nanotechnology Hub (MANTH)
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Institution: University of Pennsylvania, Philadelphia, PA, USA
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Website: https://www.nano.upenn.edu/
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Center for Functional Nanomaterials (CFN)
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Institution: Brookhaven National Laboratory, Upton, NY, USA
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Website: https://www.bnl.gov/cfn/
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Center for Integrated Nanotechnologies (CINT)
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Institutions: Sandia and Los Alamos National Laboratories, USA
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Website: https://cint.lanl.gov/
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Center for Nanoscale Materials (CNM)
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Institution: Argonne National Laboratory, Lemont, IL, USA
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Website: https://www.anl.gov/cnm
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Center for Nanophase Materials Sciences (CNMS)
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Institution: Oak Ridge National Laboratory, Oak Ridge, TN, USA
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Website: https://www.ornl.gov/facility/cnms
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The Molecular Foundry
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Institution: Lawrence Berkeley National Laboratory, Berkeley, CA, USA
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Website: https://foundry.lbl.gov/
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Kavli Nanoscience Institute
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Institution: California Institute of Technology, Pasadena, CA, USA
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Website: https://kni.caltech.edu/
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California NanoSystems Institute (CNSI)
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Institution: University of California, Los Angeles, CA, USA
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Website: https://cnsi.ucla.edu/
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National Institute for Materials Science (NIMS)
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Location: Tsukuba, Japan
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Website: https://www.nims.go.jp/eng/
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Frontier Research Center
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Institution: Tokyo Institute of Technology, Yokohama, Japan
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Website: https://www.frc.titech.ac.jp/
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Center for Nanotechnology Research and Development
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Institution: Jordan University of Science and Technology, Irbid, Jordan
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Website: https://www.just.edu.jo/FacultiesandDepartments/centers/centers/Pages/Nanotechnology.aspx
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Tel Aviv University Center for Nanoscience and Nanotechnology
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Location: Tel Aviv, Israel
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Website: https://nano.tau.ac.il/
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Center for Nanomaterials and Chemical Reactions
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Institution: Institute for Basic Science, Daejeon, South Korea
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Website: https://www.ibs.re.kr/eng/
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Center for Nanoparticle Research
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Institution: Seoul National University, Seoul, South Korea
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Website: http://cnr.snu.ac.kr/
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Institute of Nanotechnology
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Institution: Karlsruhe Institute of Technology, Karlsruhe, Germany
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Website: https://www.int.kit.edu/
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MESA+ Institute for Nanotechnology
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Institution: University of Twente, Enschede, Netherlands
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Website: https://www.utwente.nl/en/mesa/
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London Centre for Nanotechnology
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Institutions: University College London and Imperial College London, UK
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Website: https://www.london-nano.com/
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Catalan Institute of Nanoscience and Nanotechnology (ICN2)
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Location: Barcelona, Spain
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Website: https://icn2.cat/
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Centre for Nano and Soft Matter Sciences (CeNS)
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Location: Bangalore, India
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Website: https://www.cens.res.in/
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Centre for Nanoscience and Nanotechnology
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Institution: Jamia Millia Islamia, New Delhi, India
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Website: https://www.jmi.ac.in/cnsnt
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Australian Institute for Bioengineering and Nanotechnology (AIBN)
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Institution: University of Queensland, Brisbane, Australia
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Website: https://aibn.uq.edu.au/
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Flinders Institute for Nanoscale Science & Technology
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Institution: Flinders University, Adelaide, Australia
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Databases specializing in Nuclear Magnetic Resonance (NMR), Ultraviolet Photoelectron Spectroscopy (UPS)
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SDBS (Spectral Database for Organic Compounds)
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Description: A free database providing NMR, IR, MS, Raman, and ESR spectra for a wide range of organic compounds.
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Access: SDBS
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Wiley's KnowItAll NMR Spectral Library
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Description: A comprehensive collection of high-quality NMR reference spectra.
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Access: KnowItAll NMR Collection
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ACD/Labs NMR Databases
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Description: Extensive spectral libraries for ^1H, ^13C, ^15N, ^19F, and ^31P nuclei, covering a broad range of compounds.
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Access: ACD/Labs NMR Databases
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Biological Magnetic Resonance Data Bank (BMRB)
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Description: Repository for NMR spectroscopy data from proteins, peptides, nucleic acids, and other biomolecules.
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Access: BMRB
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NMRShiftDB
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Description: An open-access database for organic structures and their NMR data.
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Access: NMRShiftDB
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PubChem
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Description: Provides chemical information, including NMR spectra, for a vast number of compounds.
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Access: PubChem
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ChemSpider
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Description: A free chemical structure database providing access to spectral data, including NMR.
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Access: ChemSpider
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Human Metabolome Database (HMDB)
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Description: Comprehensive information on human metabolites, including NMR and MS spectra.
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Access: HMDB
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MetaboLights
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Description: A repository for metabolomics studies, including NMR and MS data.
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Access: MetaboLights
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Yeast Metabolome Database (YMDB)
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Description: Detailed information on yeast metabolites, encompassing NMR and MS spectra.
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Access: YMDB
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E. coli Metabolome Database (ECMDB)
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Description: Comprehensive data on E. coli metabolites, including NMR spectra.
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Access: ECMDB
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Serum Metabolome Database
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Description: Information on metabolites found in human serum, with associated NMR data.
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Access: Serum Metabolome Database
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SMPDB (Small Molecule Pathway Database)
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Description: Contains pathway diagrams and associated spectral data for small molecules.
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Access: SMPDB
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DrugBank
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Description: Comprehensive data on drugs and drug metabolites, including NMR spectra.
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Access: DrugBank
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MassBank
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Description: A public repository for mass spectra of various compounds.
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Access: MassBank
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ReSpect (RIKEN MSn Spectral Database)
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Description: A database of high-quality MSn spectra for metabolomics.
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Access: ReSpect
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Global Natural Products Social Molecular Networking (GNPS)
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Description: An open-access platform for sharing and analyzing MS data.
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Access: GNPS
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Metlin Metabolite Database
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Description: A repository of metabolite information and tandem MS data.
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Access: Metlin
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LipidMaps
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Description: Comprehensive data on lipid structures and their MS spectra.
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Access: LipidMaps
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ChEBI (Chemical Entities of Biological Interest)
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Description: Database of molecular entities focused on 'small' chemical compounds, including spectral data.
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Access: ChEBI
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NIST Chemistry WebBook
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Description: Provides access to chemical and physical property data, including IR and MS spectra.
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Access: NIST WebBook
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BioMagResBank (BMRB)
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Description: Repository for NMR data of biomolecules.
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Access: BMRB
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Protein Data Bank (PDB)
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Description: Database for 3D structural data of large biological molecules, with associated NMR data.
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Access: PDB
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ChemExper Chemical Directory
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Description: Database of chemical compounds, including spectral data.
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Access: ChemExper
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SpectraBase
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Description: A free online resource of chemical spectra.
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Access: SpectraBase
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