FLUXMATERIA — INVERSE SEARCH
Stop searching. Start specifying.
Define what you need — property ranges, constraints, tradeoffs. FluxMateria finds candidates that match and explains why others were rejected.
FLUXMATERIA — INVERSE SEARCH
Define what you need — property ranges, constraints, tradeoffs. FluxMateria finds candidates that match and explains why others were rejected.
Define targets, ranges, and hard constraints across multiple properties
Results ranked against your spec
See tradeoff frontiers when properties conflict
Know exactly why candidates didn't make the cut
Adjust spec based on what's achievable
Export shortlists with full reasoning
Input: large compound library. Output: ranked list requiring manual filtering.
Screen everything, then apply filters. Resources spent evaluating unsuitable candidates.
Input: property constraints (logP 1-3, MW <500, no PAINS, acceptable hERG). Output: matching candidates.
Define success criteria first. FluxMateria identifies candidates that satisfy constraints.
Real discovery involves tradeoffs. Inverse Search shows:
Which candidates meet all constraints
Which candidates meet most constraints (and which they miss)
When properties conflict, see the tradeoff space
What you'd gain by relaxing specific constraints
Set property targets, ranges, and hard constraints
FluxMateria evaluates candidate space
Ranked results with constraint satisfaction
Adjust spec based on what's achievable
Analyze Pareto frontiers and tradeoffs
Shortlist with decision rationale
Set target ranges for potency, selectivity, and ADMET properties. Find candidates that hit multiple criteria simultaneously.
Define band gap range, thermal stability threshold, and cost constraints. Get ranked compositions that meet your spec.
Specify solubility requirements, stability windows, and excipient compatibility. See what's achievable in your target space.
Before synthesis, understand the tradeoff landscape. Know which constraints are limiting before you start.
Inverse Search is available to beta partners. We're expanding property coverage and refining the tradeoff analysis based on real-world use.
See the full workflow: define constraints, review ranked results, analyze tradeoffs, export decisions.
View Demo →Bring your constraints. We'll help you explore the tradeoff space and find what's achievable.
Request Beta Access →