mzCloud is a novel type of mass spectral database that is able to assist analysts in identifying compounds even when they are not present in the library.
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Search of spectra by chemical name, peak, InChIKey or SPLASH.
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AMDIS has a range of other features including the ability to search the entire NIST 08 MS Library with any of the spectra extracted from the original data file.
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The Global Natural Product Social Molecular Networking (GNPS) site creates a community for natural product researchers working with mass spectrometry data.
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A basic RESTful API with simple search functions is available: Search by SPLASH · Search by InChIKey · Search by a single block of InChIKey. An improved API is ...
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Byonic is the leading tandem mass spectrometry search engine for comprehensive peptide and protein identification.
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