Laue Data Processing
Crystallographic Program Suites
- Collection of disparate programs covering most computations required for macromolecular crystallography
- ATSAS (http://www.embl-hamburg.de/biosaxs/software.html)
- Program suite for small-angle scattering data analysis from biological macromolecules. Freely available.
- Nika (http://usaxs.xray.aps.anl.gov/staff/ilavsky/nika.html)
- Program suite that can reduce area detector data into 1D “lineouts” for SAXS or WAXS. Freely available but requires the commercial package Igor Pro.
- Python based GUI developed at BioCARS to reduce time-resolved 2D area detector images into 1D data.
- Gromacs (http://www.gromacs.org/)
- Perform molecular dynamics calculations on proteins. Freely available