Changes in version 0.4.2 - Sped up spectral alignment to further improve speed of spectral library searching (by about 50%). - Added additional plot functions for ms_alignment objects: plot.ms_alignment and boxplot.ms.alignment. Changes in version 0.4.1 - Refactored spectral_similarity to speed up spectral library search. - Silenced warnings for malformed database entries in spectral library search. Changes in version 0.4.0 - Changed name of package to "mzinspectr". - Updated ms_filter_alignment so it filters matches when removing columns from the peak table. - Added titles to mass spectra plots with peak name and retention index or time. - Fixed bug in retention index matching algorithm for ms_search_spectra function. - Added fixed_levels argument to ms_reshape_peaktable so features can be plotted in the order they're provided by the user. - Changed the name of the mzinspectr alignment object from msdial_alignment to ms_alignment. Changes in version 0.3.3 - Fixed bug ms_tidy_msdial when renaming peaks that are out of order. - Renamed ms_tidy_msdial to ms_reshape_peaktable. The old function name is now deprecated. - Made some improvements to documentation. Changes in version 0.3.2 - Added option to for renaming peaks via ms_tidy_msdial by providing a named character vector. - Deprecated treatment argument in ms_tidy_msdial, replacing it with new metadata argument. Changes in version 0.3.1 - Made rcdk (for rendering structures in ms_search_gadget) suggested instead of a dependency. - Simplified ms_read_alignment function and made corrections so that correct types are read in for peak metadata fields. Missing retention indices are now correctly entered as NAs. - Added error message to search_spectra when peak retention indices are not present and added option to search entire database by setting ri_thresh to NULL. - Corrected normalization functions so they now return the peak table as a data.frame instead of a matrix. Changes in version 0.3.0 - Added support for calling MSDIAL console app directly through the ms_call_msdial function. - Improved speed of ms_search_spectra function and added progress bar. - Removed search_msp from NAMESPACE. - Added ms_search_gadget for interactively viewing search_spectra matches. - Changed names of normalization functions: tsn to ms_normalize_tsn and pqn to ms_normalize_pqn. - Added ms_rt_to_ri function for conversion of retention times to retention indices. - Added ms_ prefix to all exported functions to prevent NAMESPACE conflicts. Changes in version 0.2.0 - Update license to GPL3. - Added a NEWS.md file to track changes to the package. - Added search_spectra & search_msp functions for peak identification.