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Updated: Feb 4, 2026

Neutron Crystallography Data Collection and Processing for Modelling Hydrogen Atoms in Protein Structures
Published on: December 1, 2020
Advances in utilizing event based data structures for neutron scattering experiments
Peter F Peterson1, Daniel Olds1, Andrei T Savici1
1Neutron Scattering Division, Oak Ridge National Laboratory, Oak Ridge, Tennessee 37831, USA.
Event mode data processing in spallation neutron sources enables new scientific exploration. This method allows for flexible data analysis and improved insights from measurements, even after completion.
Area of Science:
- Neutron scattering
- Materials science
- Data science
Background:
- Spallation neutron sources widely use event recording in data acquisition systems.
- Previous data processing methods (histograms) limited temporal or file-based analysis.
- Event mode data collection offers new avenues for scientific discovery.
Purpose of the Study:
- Demonstrate advancements in data processing using event mode measurements.
- Explore new scientific possibilities enabled by event mode data.
- Highlight techniques for analyzing time-dependent data and improving measurement strategies.
Main Methods:
- Review principles of event data acquisition and processing.
- Introduce techniques for exploring temporal changes in event mode data.
- Apply hierarchical clustering for model-independent data grouping and analysis.
Main Results:
- Event mode data allows for post-measurement data exploration and rebinning.
- Statistical methods for determining data quality and optimal measurement duration are demonstrated.
- Hierarchical clustering effectively improves calibration, reduction, and data exploration.
Conclusions:
- Event mode data processing significantly enhances the capabilities of spallation neutron sources.
- This approach unlocks new possibilities for in situ measurements and detailed data analysis.
- Advanced data analysis techniques, like hierarchical clustering, are crucial for maximizing scientific return.
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