Tools for simulating x-ray diffraction. Detailed documentation is found at the below link.

ISPyB web application

ImageD11 is a python code for identifying individual grains in spotty area detector X-ray diffraction images.

Data processing for serial crystallography

Structural Analysis of Porphyrinoids & Corrinoids

refleX - A system for automatic anomaly detection in X-ray diffraction images.

Distribution of LaueTools Package for Laue pattern analysis

Ab initio Modelling of Proteins for moLEcular replacement

Sequence Independent Molecular replacement Based on Available Database

C++ package that provides tools for correcting structural predictions of proteins (eg. from X-Ray Crystallography or AlphaFold) using X-ray small-angle scattering (SAXS) in solution

Python functions for reading refinement data from Jana2006

Solving structures With Alpha helical Membrane Pairs

This repository is for a simple C++ console application that can read POSCAR files and print atomic distances between one atom and a selection of other atoms.

Search for new PDB structures corresponding to a search term and deposited after a certain date.

Wrapper for Precognition to simplify Laue data reduction

Read, write, and manipulate diffraction images that use the MarCCD format

Calculate τ (Tau) Values (Geometry Index) for 4- and 5-coordinate complexes.

In this module, you will learn to solve protein structure from crystallography data. This course will cover detailed aspects of protein structures, from primary to quaternary levels, and explores physiochemical principles using common bioinformatics tools