TRION Cloud
The no-install drug discovery AI workflow
Run AI-driven drug discovery workflows in the cloud, as much as you need — with no install and no infrastructure to set up.
Start with no install
Run straight from your browser — no software to install, no servers to set up.
Compute on demand
Run compute at the scale your research needs and pay only for what you use.
Expanding workflows
Starting with Virtual Screening and AI Co-folding, with more capabilities to come.
Connected to analysis
Integrated all the way through selecting, comparing and reviewing your results.
Why TRION Cloud
Faster compute, seamless analysis, lower cost
Run AI-based drug discovery computations without standing up complex infrastructure, and carry every result through analysis and structure review in a single research flow.
Start with zero setup
No infrastructure to build and nothing to install — start computing right in your browser.
~1/10
compute cost vs. traditional HPC
~21 min
to dock 10,000 compounds
One flow into analysis
Filtering, clustering and structure review all continue without a break.
Built on proven AI models
Reproducible results on published, peer-reviewed docking and folding engines.
2024 Good-R&D Award
Recognized with the Good-R&D Award for its compound screening solution.
From first screen to lead series
Start on a new target or refine an existing series with the same set of tools.
Hit discovery
Virtual-screen a large library against a new target to rank your first actives.
Binding-mode check
Cofold a hit to see the predicted complex and confirm the binding mode in 3D.
Hit-to-Lead
Generate compound analogs and predict their activity.
Workflow
From compute to analysis to structure review, in one flow
TRION Cloud connects AI-driven compute, result analysis and structure review in one cloud environment. It currently offers the Virtual Screening and AI Co-folding workflows.
Virtual Screening
Explore large candidate sets faster and more systematically
GNINA-based AI docking predicts the binding potential of thousands to tens of thousands of compounds, then selects promising candidates through docking-score and property-based filtering and structure-similarity clustering.
- GNINA-based AI docking
- Automated protein and ligand preparation
- Docking-score & property-based filtering
- Structure-similarity clustering
- Result table and 3D pose review
- Export to CSV, SDF, PDB
AI Cofolding
Predict the binding structures of diverse biomolecules with AI
Boltz-2-based AI Co-folding predicts the binding structures of diverse biomolecular complexes — proteins, ligands, DNA/RNA and more. Check a molecule's binding structure on its own, or review Virtual Screening candidates at the structural level.
- Boltz-2-based binding structure prediction
- Protein–ligand complex prediction
- Protein–protein interaction prediction
- Protein–DNA/RNA structure prediction
- 3D review of predicted structures
- Save result structure files
Less time using the tool
Preview instantly
Type a PDB ID and see the structure load in the viewer — check your target before the run.
Target Protein
1HSG · 2 chains · Auto Box
Ligand Library
Diversity Library 10K · 10,238
Project Settings
gnina · exhaustiveness 4
Unify workflows
Everything from upload to export happens in one place.
Result analysis
Sort and cluster by analysis results to improve usability.
How it works
From AI compute to result review, in one flow
Once your input data is ready, TRION Cloud takes you from AI-based computation through candidate filtering, structure review and file export — all in one place.
Prepare inputs
Upload your input data, such as target proteins or compound structures.
Run compute
Run AI-based computation based on the workflow you choose.
Filtering
Narrow down promising candidates by score and physicochemical properties.
Clustering
Group and compare candidates by structural similarity.
Structure review
Inspect result poses in 3D, and predict the bound structure with AI Co-folding when needed.
Export
Save results in the formats your research needs — CSV, SDF, PDB and more.
Pricing
Pay only for the compute you need, as you use it.
TRION Cloud is credit-based, so you run only the compute you need. Scale flexibly from a quick test to large-scale screening, right-sized to your research.
Virtual Screening
Screen large compound libraries against your target. You pay per ligand, with no setup fee.
$0.01
per ligand screened
1 credit each
AI Cofolding
Predict the bound protein–ligand complex and view it in 3D. You're charged per complex you fold.
From $1
per folded complex
100 credits each
Start your cloud drug discovery AI workflow with free credits.
Get 500 credits with no card required, and try TRION Cloud's drug discovery AI workflows right away.