dkratzert

StructureFinder

A crystal structure finder written in PyQt5 and Python3

FinalCif

A CIF file finalizer for small molecule crystallography with as much automation as possible.

ShelXFile

A parser and editor for SHELXL files.

DSR

Refinement of disordered structures with SHELXL

messlog

A measurement logging and organizing project

Iterative-Closest-Point

Implementation of the iterative closest point algorithm. A point cloud is transformed such that it best matches a reference point cloud.

multitable

CellOpt

a program for refining the unit cell against known interatomic distances.

dkratzert.github.io

elsie

Python framework for making slides

FragmentDB

A port of DSR to Olex2

imolecule

An embeddable webGL molecule viewer and file format converter.

Mieres-2018

overflows

prints out in which Bruker frames are overflows

platon_update

updates platon and check.def

plotxd

R_complete

A grahpical user interface for computing R_complete with SHELXL.

scale_factors

sliderepl

Imported from https://bitbucket.org/zzzeek/sliderepl

sqlacodegen

Automatic model code generator for SQLAlchemy

Titrino

Updater

A minimal updater for Windows programs

VideosSampleCode

Code from the mCoding sample videos

vtk-python-examples

A collection of VTK examples in Python

website

xp-patch

A tiny script to patch Brukers XP to handle RIGU and ABIN