New Exploration
What have you got?
This sets what happens next. You can change it afterwards.
Where is it?
What should happen?
Each of these can be left out. A run that only analyses is a run with one of them ticked.
Anything to change?
Every setting has a default that works. These are here for when it does not.
Run it here, or take it with you
The same file either way. A laptop is a poor place to run a long simulation; a cluster is a poor place to decide what to run.
Overview
Live health classification will appear once telemetry has been written.
Stage timeline
- Setup
- Minimization
- NVT
- NPT
- Production
- Analysis
- Report
Exploration progress
| Phase | Status | Detail |
|---|
Trajectory statistics
| Metric | Average | Std. dev. | Unit |
|---|
Live Simulation
Progress
| Current stage | not available |
|---|---|
| Current step | not available |
| Total planned steps | not available |
| Frames written | not available |
| Simulation time | not available |
| Elapsed wall time | not available |
| ETA | not available |
| Checkpoint | not available |
| Last update | not available |
Mini molecular preview
Open full viewerUpdates automatically as the simulation progresses.
Live charts
Simulation health
normalnot available
Plain-English explanation of the latest sample.
Recent events
Molecular Viewer
Analysis
Report
Exploration completed
Reports
Simulation files
Analysis files
Settings
Viewer
Dashboard
Exploration display
These preferences affect only how the dashboard renders this run. They do not modify the OpenMM simulation or any output files.