Chemical Information Sources/SIRCh/Analytical Chemistry Searches

SIRCh: Selected Internet Resources for Chemistry

Spectral Sources

• Spectra and Spectral Data (A. Ben Wagner's guide, University of Buffalo)
• SDBS Spectral Database for Organic Compounds
• Finding authentic chemical spectra (IR, NMR, UV) in the Purdue University Libraries by Song Yu
• Spectroscopic Tools at the University of Potsdam
• MS Links at Scientific Information Services
• i-mass.com
• LaSurface XPS and AES Database
• FTIR Raman search.com
• Ryan's Blog on NMR Software
• FTNMR FID (Free Induction Delay) Archive
• NMRShiftDB
• NMR Information Server
• MAG-NET: Molecular Spectroscopy Lab (University of Akron)
• BiomagResBank (BMRB) (a repository for data from NMR spectroscopy on proteins, peptides, and nucleic acids)
• SUGABASE HTML version (CarbBank plus proton and carbon chemical shift values)
• SUGABASE JAVA version (CarbBank plus proton and carbon chemical shift values)
• Electron Spin Resonance Software Database (NIEHS/NIH)
• IRUG Spectral Database (infrared and Raman)
• PhotochemCAD Spectra by Category

Crystallographic Sources

• COD: Crystallography Open Database
• Subject Guide: X-Ray Crystallography (University of Wisconsin)
• ALB Crystallography Search Engine
• Indiana University Molecular Structure Center
• IUCr Crystallographic Information File (CIF)
• Cambridge Crystallographic Data Centre
• Cambridge Structural Database (CSD) Documentation
• PowBase Powder Patterns Database
• SINCRIS: Information Server for Crystallography
• Protein Crystallography Beamlines at Photon Factory (Japan)
• Atomic Scattering Factors for the Elements
• Interactive Crystallography (Requires Xmaple and HTML forms)

Structural Databases: Biological Molecules

See : SIRCh: Structure Searches

Amino Acids, Peptides, and Proteins: Structural Databases

• Entrez, the Life Sciences Search Engine (NCBI)
• UniProt (Integrated Protein Informatics Resource for Genomics, Proteomics, and Systems Biology)
• Protein Data Bank (PDB)
• Molecules to Go (formerly, Molecules R Us)
• SCOP Structural Classification of Proteins
• OWL (Composite Protein Sequence Database)
• Bioinformatics at the Kennedy Krieger Institute and the Johns Hopkins University
• BiomagResBank (BMRB) (a repository for data from NMR spectroscopy on proteins, peptides, and nucleic acids)
• Amino Acids at the Free University of Berlin

Nucleic Acids: Sequence and Structural Databases

• Entrez, the Life Sciences Search Engine (NCBI)
• GenBank (a Genetic Sequence Database with All Known DNA Sequences from NCBI, the National Center for Biotechnology Information)
• The Nucleic Acid Database at Rutgers

Miscellaneous Sources for Analytical Chemistry

• Chemconnections Smells Database (University of California, Berkeley)
• STARLIMS Laboratory Information Management Systems
• ASDL Analytical Sciences Digital Library]
• Little Encyclopedia of Mass Spectrometry
• spectroscopyNOW.com
• Current Protocols Online resource for publications on laboratory methods in genetics, protein science, immunology, biochemistry, molecular biology research, and more. (Wiley)
• NIOSH Manual of Analytical Methods (NMAM)
• Reagent Chemicals (ACS)
• LIMSource
• Fiveash Data Management Reference Spectra Databases
• CHIRBASE Molecular Database for Chiral chromatography
• Society for Applied Spectroscopy
• Encyclopedia of Analytical Instrumentation
• Electrochemical Science and Technology Information Resource (ESTIR)
• Solv-DB (Solvent Data)
• [http://www.chromatography-online.org/ Chrom-Ed Series (Chromatography Books by Dr. R.P.W. Scott)
• Flavornet (Cornell University)
• The Good Scents Company

Printed Sources for Analytical Chemistry Information

• Analytical Chemistry (Constitutional Chemistry) (Indiana University)