SpiceHit, a tool for high-throughput analyses of the data obtained by CE-MS with single ion monitoring (SIM) method, was updated. In the peak identification, a function to suggest only the best peak corresponding to each standard compound was implemented, where all the candidate peaks have been enumerated so far.
MFSearcher was updated. A search function for the 15062 metabolites published at the Human Metabolome Database (HMDB, Version 3.0) was implementes.
MFSearcher is a web service for rapid prediction of elemental compositions and rapid search for compound databases by mass values detected in metabolomics studies.