2.8.0-dev0

MDAnalysis
User guide
MDAKits

Documentation

1. Overview over MDAnalysis
2. The topology system
3. Selection commands
4. Analysis modules
5. Topology modules
6. Guesser modules
7. Coordinates modules
8. Converter modules
9. Trajectory transformations (“on-the-fly” transformations)
10. Selection exporters
11. Auxiliary modules
12. Core modules
13. Visualization modules
14. Library functions — MDAnalysis.lib
15. Version information for MDAnalysis - MDAnalysis.version
16. Constants and unit conversion — MDAnalysis.units
17. Custom exceptions and warnings — MDAnalysis.exceptions
18. References

MDAnalysis

14. Library functions — MDAnalysis.lib
14.2.1. Fast distance array computation — MDAnalysis.lib.distances
14.2.2.2. Parallel distance calculation library — MDAnalysis.lib.c_distances_openmp
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14.2.2.2. Parallel distance calculation library — `MDAnalysis.lib.c_distances_openmp`

Contains OpenMP versions of the contents of “calc_distances.h”

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