136 skills found · Page 3 of 5
blokhin / Cif Js EnginesBrowser plugin-free CIF visualization: comparison of the open-source engines
xia2 / Xia2An expert system for automated reduction of X-ray diffraction data from macromolecular crystals
maffettone / XcaCrystallography Companion Agent
dkratzert / FinalCifA CIF file finalizer for small molecule crystallography with as much automation as possible.
OpenChemistry / CrystalsCrystallographic files of common materials, elements, oxides, for visualization in Avogadro
spglib / SpinspgPython package for detecting spin space group on top of spglib
ppinard / EbsdtoolsTools to use in EBSD analyses (crystallography, read/write file, etc.).
SHDShim / PeakPoX-ray diffraction data analysis for high pressure and high temperature experiments
keitaroyam / Yamtbxmy crystallographic toolbox
cameronmcelfresh / Xrd SimulateMATLAB Code to Simulate Basic XRD Patterns
tilde-lab / TildeMaterials informatics framework for ab initio data repositories
OctaDist / OctaDistA tool for calculating distortion parameters in coordination complexes.
JensKrumsieck / ChemSharpLibrary for processing of chemistry related files (aiming at spectroscopy and structural files)
taw10 / CrystfelData processing for serial crystallography
natechols / Xtal.jsJavaScript code for X-ray crystallography applications
mtplr / PyMol CookbookSome notes (cookbook) for pyMol. Protein Crystallography course.
dkratzert / StructureFinderA crystal structure finder written in PyQt5 and Python3
manny405 / McseMolecular Crystal Simulation Library (mcse) is an open-source Python package for manipulating and analyzing molecular crystal structures
AGI-init / XRDsThe repo for x-ray diffraction pattern crystallography via deep learning.
aronwalsh / CrystallographyOnline resource for introduction to crystallography at Imperial College London (MATE40004)
