From months of guessing
to minutes of certainty.
The Old Way
Slow correlation
Weeks to correlate simulation results with physical lab tests.
Costly iteration
Testing every composition in the furnace burns budget and time.
Optimization gaps
Multi-objective trade-offs (strength vs weight) are hard to balance.
With AuraOne
Instant prediction
Property predictions available within 8 minutes for 200 structures.
Virtual screening
Screen thousands of candidates. Only synthesize the best.
Closed loop
Lab results feed back into the model, improving accuracy every run.
Discovery infrastructure
from hypothesis to production.
Six tools. One platform. Validated materials.
Property Prediction
Predict mechanical properties from CIF structures. Estimate stability and density instantly.
Multi-Objective Design
Optimize compositions for conflicting targets like strength vs. weight vs. cost.
Lab Correlation
Ingest XRD and tensile test results to validate predictions and close the simulation gap.
High-Throughput Screening
Upload crystal structures for batch analysis. Screen thousands of candidates before scheduling furnace time.
Cost Overlays
Overlay supply chain constraints and raw material costs on top of performance metrics.
Model Fine-Tuning
Retrain predictors on combined sim-lab datasets using M3GNet and XGBoost ensembles.
From research to production.
Context never lost.
Every hypothesis archived. Every experiment versioned. Manufacturing ready.
Ideate
Composition sliders update properties in real time. Cross-domain inspiration from Drug Discovery and Climate Labs.
Validate
High-throughput predictions compared with instrument snapshots. DOE templates adjust to emergent covariates.
Transfer
Digital twin exports align with PLM and MES stacks. Compliance packets cover ASTM, ISO, ITAR.
Why teams switch
to AuraOne.
Enterprise-grade security.
Research-grade integrity.
SOC 2 Type II
Audited security controls. Encrypted data at rest and in transit.
Regression Bank
Every experiment archived with immutable provenance. Reproducible science.
IP Protection
Private clouds, on-prem options, and air-gapped deployments available.