DAPHNE4NFDI

CrystFEL is a suite of programs to process data from "serial crystallography" experiments.

DAMNIT (Data And Metadata iNspection Interactive Thing) is a tool developed by the Data Analysis group at the European XFEL to provide users with a way to automatically create an overview of their experiment, hopefully replacing the manually-created spreadsheets that are often used.

Configurable python-Flask application for structured data capture and exploration.

Compute Neutron and X-ray reflectivity from molecular dynamics simulations.

Python CLI & API for converting heterogeneous experimental data into validated NeXus (HDF5) files using reusable mapping templates and extensible workflows.

Pydidas (Python diffraction data analysis suite) is a toolkit for the analysis of X-ray diffraction datasets. It is designed to be accessible also for domain scientists with little experience in diffraction data analysis. Pydidas includes a graphical user interface and a command line interface.

Reflectorch is a Python package for the analysis of X-ray and neutron reflectivity data using Pytorch-based neural networks. It provides fast simulation of reflectometry curves by GPU, parameterization via YAML configuration files, and prior-aware training.

Sassena is a program to calculate X-ray and neutron scattering patterns from Molecular Dynamics simulations in the Born approximation.