German Engineering Materials Science Centre (GEMS)
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Made2Reflect
Compute Neutron and X-ray reflectivity from molecular dynamics simulations.
- Data analysis
- Matter
- Molecular Dynamics
- + 4
- Python
- Shell
- Dockerfile
2
0
pydidas
Pydidas (Python diffraction data analysis suite) is a toolkit for the analysis of X-ray diffraction datasets. It is designed to be accessible also for domain scientists with little experience in diffraction data analysis. Pydidas includes a graphical user interface and a command line interface.
- SAXS
- WAXS
- X-ray diffraction analysis
- + 1
- Python
- Batchfile
- Makefile
- + 1
2
7
Sassena
Sassena is a program to calculate X-ray and neutron scattering patterns from Molecular Dynamics simulations in the Born approximation.
- C++
- High performance computing
- Matter
- + 2
- C++
- Python
- Shell
- + 2
3
59