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🤖 Self-Driving Lab: Automated Synthesis Optimizer

Robotic liquid handler, flow-chemistry reactor and an in-line analyzer run an autonomous self-driving lab: Bayesian optimization proposes reaction conditions, watch the live response surface converge on the highest-yield recipe faster than random or grid search.

Chemistry & Materials3DAdvanced60 FPS💧 Water

Details

CategoryChemistry & Materials

RenderingThree.js · WebGL

DifficultyAdvanced

Target FPS60

ControlsStart optimization run button launches an autonomous dispense-flow-analyze cycle; budget slider (5-40) sets total iterations; Bayesian / Random search buttons pick the proposal strategy (locked while a run is active); Reset clears samples, the response surface and the convergence chart.

Three.jsself-driving labflow chemistryliquid handlerBayesian optimizationresponse surfaceautomated synthesis

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⚙ Under the hood

A self-driving lab loop: a gantry liquid handler dispenses reaction mixtures onto a plate, a coiled flow-chemistry reactor carries each one through continuous flow, and an in-line analyzer reads back the yield. A Bayesian optimizer proposes the next concentration/temperature pair from a live response-surface model (mean estimate plus an exploration bonus), converging on the true optimum in far fewer runs than random or full grid search - compare both strategies on a shared convergence chart.

Three.jsself-driving labflow chemistryliquid handlerBayesian optimizationresponse surfaceautomated synthesis

3D · Three.js / WebGL renderer · 60 FPS target · runs fully client-side, no install