An AI that does
chemistry.
Building AI-augmented molecular simulation for drug discovery, materials science, and sovereign defence capability.
Chemistry is slow.
Computation changes that.
Traditional molecular discovery relies on iterative experimental cycles. Months of synthesis and testing to validate a single hypothesis.
Orbital is built to compress that timeline. AI-orchestrated computational chemistry that screens, simulates and ranks molecular candidates before anyone runs an experiment.
Drug Discovery
Computational screening of molecular candidates, from binding affinity prediction to ADMET profiling. Built to shorten the path from target to lead.
Synthesis Planning
AI-driven retrosynthetic analysis. It finds workable routes from commercially available precursors to the target molecule.
Materials Science
Molecular dynamics and quantum chemistry applied to novel materials. Predict the properties before synthesis and you cut experimental cycles.
Energy Storage
Computational design of next-generation battery chemistries. Electrolyte optimisation, cathode screening and solid-state modelling.
Describe
Define the molecular problem space. Target structures, desired properties, constraints, and success criteria.
Orchestrate
AI selects and sequences the right computational methods, then assembles docking, molecular dynamics and quantum chemistry into one automated pipeline.
Discover
Validated candidates, ranked and characterised, ready for experimental verification with full computational provenance.
Built for sovereign
capability.
Built for classified networks. Containerised, air-gappable, with no external dependencies. UK sovereign. Five Eyes aligned.
Interested in Orbital.
If you need computational chemistry capability for defence or industry, the Computational Science division would like to hear from you.
hello@viamachina.ai