Mass-Spectra Prediction Using the FIORA Model

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Documentation for package ‘fioRa’ version 0.3.4

• DESCRIPTION file.
• Package NEWS.

Help Pages

install_fiora	Install the python module 'fiora' into a conda environment.
run_app	Run the Shiny Application.
run_script	Predict MS^2 fragment spectra from SMILES code.
test_data	The example set of test compounds provided with FIORA.