NEWS

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isoorbi 1.3.1 (2024-08-27)

This is a patch containing compatibility updates.

isoorbi 1.3.0 (2023-11-09)

This is a minor release adding new features.

Breaking changes

There are no breaking changes in this release (all changes and new features are backwards compatible).

New features

Plotting functions:

• orbi_plot_satellite_peaks() implemented
• orbi_plot_isotopocule_coverage() implemented
• orbi_plot_raw_data() implemented

Information functions:

• orbi_get_isotopocule_coverage()

Enhancements

• orbi_simplify_isox() now includes intensity by default and allows addition of user-specified columns
• orbi_flag_satellite_peaks(), orbi_flag_weak_isotopocules() and orbi_flag_outliers() now provide additional information when no data is flagged and how to visualize what was flagged (if anything)

Bug Fixes

• orbi_add_blocks_to_plot() now supports log scale axes

isoorbi 1.2.0

This is a minor release adding new features.

Breaking changes

There are no breaking changes in this release (all changes and new features are backwards compatible).

New features

• orbi_find_isox() added
• orbi_analyze_noise() implemented
• orbi_plot_shot_noise() implemented
• orbi_flag_satellite_peaks(), orbi_flag_weak_isotopocules() and orbi_flag_outliers() supersede orbi_filter_satellite_peaks(), orbi_filter_weak_isotopocules() and orbi_filter_scan_intensity()
• orbi_export_data_to_excel() implemented
• orbi_define_block_for_flow_injection() implemented
• orbi_add_blocks_to_plot() implemented

Enhancements

• all loading and utility functions provide more details in the info message about what has been done, what was affected, and how long it took
• all loading and utility functions catch processing errors and report the information back to the user
• orbi_read_isox() now can read multiple .isox files at once and includes the .isox filepath in the resulting tibble

Bug fixes

• data frame groupings introduced in flagging/filtering functions are now removed again at the end of the function

isoorbi 1.1.0 (2023-06-24)

This is a minor release adding new features and fixing a few bugs.

Breaking changes

There are no breaking changes in this release (all changes and new features are backwards compatible).

New features

• implemented functionality for dual inlet data acquisitions, see orbi_define_blocks_for_dual_inlet() and orbi_get_blocks_info()
• implemented package settings, using internal functions isoorbi::orbi_get_settings, isoorbi::orbi_set_settings

Enhancements

• removed dependency on stringr
• implemented native pipe |> (R version requirement increased to 4.1.0) and removed dependency on magrittr
• added .by parameter for orbi_summarize_results() for option to manually adjust grouping

Bug fixes

• dplyr changes to joins with explicit multiple argument. multiple now defaults to "all", and the options of "error" and "warning" are now deprecated in favor of using relationship.

isoorbi 1.0.0 (2022-10-17)

First public release.