Examples

reciprocalspaceship facilitates working with reflection data in Python. It provides IO methods for reading/writing MTZ files, and a pandas-style interface for inspecting data and prototyping new analysis methods.

Here are a few examples to help you get started with reciprocalspaceship and highlight some use cases.

Note

Each of these examples is contained within a Jupyter notebook. Feel free to view the examples in the browser by following the links below. These notebooks can also be viewed interactively on binder or by downloading the notebook files from the Examples Directory and starting a notebook server.

• Basics
• HEWL S-SAD Merging Statistics
• Merging with a Robust Error Model
• Anomalous Difference Map
• Anomalous Differences in Real Space
• Time-Resolved Difference Map