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AI agent for process development scientists

Design of Experiments Iteration Agent

Find robust process conditions in as few runs as possible

Design of Experiments Iteration Agent: what goes in, what the agent does and what you get

What it does

Optimizing a process means testing combinations of temperature, time, concentration and other factors, and each lab run costs time and material. This agent proposes an experimental design that fits your factor ranges and run budget. The scientist approves each round before it goes to the lab. When results come back, the agent fits a model, checks its quality and residuals, and identifies which factors matter. Runs with a known lab error are excluded with a note. If the model is weak or the optimum sits at the edge of the tested range, it proposes the next round, such as extending a range or adding center points to test curvature. It stops when the optimum is found with enough confidence or the run budget is used. It then writes the optimum conditions with confidence ranges. Edge case: a run with a known pipetting error is excluded and noted, not silently dropped.

How it works

Follow the arrows from top to bottom. The orange dashed arrow is the loop: when a check fails, the agent goes back and tries again.

Start and resultWhat it doesA check on its own workWaits for your OKGoes back and retries
ApprovedYes, continueNo 1 STARTS WHEN Optimization starts 2 DOES Propose design within factor ranges and budget 3 YOU APPROVE Scientist approves the round 4 USES A TOOL Load results from the lab 5 USES A TOOL Fit model and check residuals 6 CHECKS THE RESULT Is the model good and the optimum inside the testedrange? If not: propose the next round with extended ranges orextra points. Back to step 2. 7 DOES Write optimum conditions with confidence ranges 8 RESULT Optimization report
Read the steps as a list
  1. Optimization starts
  2. Propose design within factor ranges and budget
  3. Scientist approves the roundThe agent waits here for your OK.
  4. Load results from the lab
  5. Fit model and check residuals
  6. Is the model good and the optimum inside the tested range?If not: propose the next round with extended ranges or extra points. Back to step 2.
  7. Write optimum conditions with confidence ranges
  8. Optimization report

How it decides

It fits a model each round and proposes the next design when the model is weak or the optimum lies at a range edge.

  • Extend ranges when the optimum is at an edge
  • Add center points to test curvature
  • Stop when the run budget is used

Make it yours

Every agent is a starting point. You choose these settings for your own situation.

  • Run budget
  • Factors and ranges
  • Model quality threshold
  • Report format

What keeps you in control

It always asks you first

  • Each experimental round
  • Final process conditions

Hard limits

  • Never runs experiments itself
  • Never excludes data without a note

It stops when

  • Done: optimum found with confidence
  • Stop: run budget used; report best known conditions

Set it up

We guide you through the set-up, step by step

Members get the full set-up guide for this agent. No technical skills needed: you copy, paste and upload.

10 minto set it up in your AI
5 AIsChatGPT, Claude, Copilot, Gemini, Grok
  • One set of instructions to paste into your AI, with the clicks for ChatGPT, Claude, Microsoft 365 Copilot, Gemini and Grok
  • The agent then walks you through connecting your own data, one source at a time
  • A downloadable copy with the flow chart, the rules and the full guide
Get access to this agent

An example run

What happensRound 1 of 16 runs placed the best yield at 60 C, the highest temperature tested, so the edge check failed. Run 7 was excluded for a known pipetting error. The agent proposed extending the range by 10 degrees with 4 center points. The scientist approved. Round 2 gave a good model with the optimum at 68 C and 91% yield, inside the range. The report went out with 24 of 30 budgeted runs used.

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