Overview

Here, we present a (growing) series of working examples of how to use the NMRAspecds package to perform both, day-to-day routine tasks and different plotting options in a laboratory working with NMR spectroscopy.

For each of the examples, a full recipe is provided ready to be copied and pasted and run on your local computer.

Note

For each of the recipes provided so far, the NMRAspecds package (at least its repository on GitHub) contains the real example data as well. Therefore, you can download the data and recipe to get first-hand experience with the NMRAspecds package.

Prerequisites

To be able to run the example recipes locally, you need to have a working installation of the NMRAspecds package and its dependencies. Have a look at the installation instructions for details.

Furthermore, to be able to run (“cook”) the recipes and get (“serve”) the results, you need to have access to a command line, as running recipes (still) is command-line based using the command serve recipe.yaml.

Optional: For some recipes, you will need to have a working LaTeX installation in case you would like to get your reports not only created, but compiled into a well-formatted PDF document as well.

Note

The path to the data in the recipes assumes the directory layout of the NMRAspecds package. Hence, the easiest way is to clone or download the repository from GitHub, change into the examples directory and there into the respective subdirectory and run the corresponding recipe.