If you’re making use of any RSS packages, amazing! Please cite them as follows:
reciprocalspaceship: a Python library for crystallographic data analysis. Greisman, Jack B. and Kevin M. Dalton, Doeke R. Hekstra. Journal of Applied Crystallography, 2021
A unifying Bayesian framework for merging X-ray diffraction data. Dalton, Kevin M. and Jack B. Greisman, Doeke R. Hekstra. Nature Communications, 2022
Laue-DIALS: open-source software for polychromatic X-ray diffraction data. Hewitt, Rick A. and Kevin M. Dalton, Derek Mendez, Harrison K. Wang, Margaret A. Klureza, Dennis E. Brookner, Jack B. Greisman, David McDonagh, Vukica Šrajer, Nicholas K. Sauter, Aaron S. Brewster, Doeke R. Hekstra. Structural Dynamics, 2024
MatchMaps: non-isomorphous difference maps for X-ray crystallography. Brookner, Dennis E. and Doeke R. Hekstra. Journal of Applied Crystallography, 2024
The following publications explore, expand upon, or apply RSS packages. If there’s a paper we’re missing, or you’ve recently published a paper using an RSS package, please let us know!
Resolving DJ-I glyoxalase catalysis using mix-and-inject serial crystallography at a synchrotron, Zielinski et. al. bioRxiv (preprint)
Scaling and merging time-resolved Laue data with variational inference, Zielinski et. al. bioRxiv (preprint)
Sensitive detection of structural differences using a statistical framework for comparative crystallography, Hekstra et. al. bioRxiv (preprint)
Perturbative diffraction methods resolve a conformational switch that facilitates a two-step enzymatic mechanism, Greisman et. al. PNAS, 2024
Emerging Time-Resolved X-Ray Diffraction Approaches for Protein Dynamics, Hekstra et. al. Annu. Rev. Biophys., 2023
Correcting systematic errors in diffraction data with modern scaling algorithms, Aldama et. al. Acta Crystallographica D, 2023
Online Inference of Structure Factor Amplitudes for Serial X-ray Crystallography, Dalton et. al. Machine Learning for Structural Biology Workshop, NeurIPS 2022
Native SAD phasing at room temperature, Greisman et. al. Acta Crystallographica D, 2022