MDANSE
MDANSE copied to clipboard
[WIP] Storing and re-using atom selections
Description of work This PR, once complete, will implement a way of storing, previewing and re-using atom selections. The atom selection definitions are meant to be abstract and do not have to be tied to a specific trajectory file.
Fixes Complete:
- Added the option of loading a selection from an MDA file. In progress:
- Planning to add an extra tab to the GUI, which will allow users to choose one of the stored selection operation sequences, and preview the effect it will have on a specific trajectory.
- Planning to add an extra selection operation, which will group and apply atom selection done in the 3D view by clicking on individual atoms.
- Initial work has been done on adding code to the backend for storing atom selections.
To test Will be filled out later.