RA Docking workspace


Provide a mnemonic name of the job for your convenience. Visible to the public.
Keep default for full-panel docking, or switch to selected mode for custom target subsets.
Docking guidance

How this docking step fits into the platform

This page turns curated target knowledge into a runnable computational task. Use it as the launch point for creating jobs, validating molecule inputs, and moving into downstream results review.

Workflow
  • Define a clear job name for this submission.
  • Add ligand entries and complete the molecular structure input.
  • Choose all targets or a selected target subset.
  • Submit the job and continue into the results workspace.
Validation rules
  • Each entry needs both a ligand name and a valid molecular structure.
  • Duplicate ligand names and duplicate structures are rejected.
  • Private jobs are visible only to the creator.
After submission
Track the job in All Jobs, open the job details page to review docking outputs, and use downstream plots and summaries to compare results across runs.