- Added additional statistical values to `-summary.xlsx`
- Added `y_value_at_peak` to `-samples.xlsx` to output peak height
- Fixing bug in `avg_cv` code
- Adding new column `avg_cv` to the `-summary.xlsx` spreadsheet
- Fixing problem with `convert_raw_to_melted_xlsx` not working when the
raw potentiostat data file has extra lines in its file header
- Changing default voltage for the right side of the normalization (i.e.,
"detilting") window to 1.135.
- Improving plotting code.
- Fixing bug with export of `process_voltammograms`
- Fixing bug where the `stringr` dependency wasn't listed in DESCRIPTION.
- Adding Gaussian kernel smoothing between the log-transformation step
and the detilting step, for compatibility with voltammograms from the
SIMStat.
- The `process_voltammograms` function now will not give an error if there
are extra named (or unnamed/empty) columns in the input spreadsheet of
melted data, other than the four required columns named `potential`,
`device`, `conc`, and `current`. The script will now just ignore the
extra columns.
- Script can now handle the case where there are different combinations
of device identifiers (i.e., device/replicate numbers) used at different
analyte concentration levels. Prior to this fix, in such a use-case,
the script would error out with an obscure and un-helpful error message.
- In the `-processed.xlsx` file, save (for each sample) the potential at
which the local maximum (analyte peak) was found, in column
`peak_potential`.
- Change analysis method to use a smoothed spline fit to censored data, for
background model
- Added MIT license.
- Merged to `development` branch on 2022-07-14
- Provides the `convert_raw_to_melted_xlsx` function
- Merged to `main` branch on 2022-07-14
- First version released; provides the `process_voltammograms` function