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faunus
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Generate PSCs text trajectory containing. More...
#include <analysis.h>


Public Member Functions | |
| PatchySpheroCylinderTrajectory (const json &j, const Space &spc) | |
Public Member Functions inherited from Faunus::analysis::QRtraj | |
| QRtraj (const json &j, const Space &spc, const std::string &name="qrtraj") | |
Public Member Functions inherited from Faunus::analysis::Analysis | |
| void | to_json (json &j) const |
| JSON report w. statistics, output etc. | |
| void | from_json (const json &j) |
| configure from json object | |
| void | to_disk () |
| Save data to disk (if defined) More... | |
| void | sample () |
| Increase step count and sample. More... | |
| int | getNumberOfSteps () const |
| Number of steps. | |
| Analysis (const Space &spc, std::string_view name) | |
| Analysis (const Space &spc, std::string_view name, int sample_interval, int number_of_skipped_steps) | |
Additional Inherited Members | |
Public Attributes inherited from Faunus::analysis::Analysis | |
| const std::string | name |
| descriptive name | |
| std::string | cite |
| url, doi etc. describing the analysis | |
Protected Attributes inherited from Faunus::analysis::QRtraj | |
| std::function< void()> | write_to_file |
| Write a single frame to stream. | |
| std::unique_ptr< std::ostream > | stream = nullptr |
| Output stream. | |
Protected Attributes inherited from Faunus::analysis::Analysis | |
| const Space & | spc |
| Instance of Space to analyse. | |
| int | sample_interval = 0 |
| Steps in between each sample point (do not modify) | |
| int | number_of_samples = 0 |
| counter for number of samples | |
Generate PSCs text trajectory containing.
This can be used to generate VMD visualisation using a conversion script (see scripts/ folder)
1.8.13