Research Partnerships

Autonomous chemistry AI research with Maria™

Molecule.one is partnering with CDMOs, Pharma, Biotechs and Frontier AI to license Maria™ AI for deep autonomous research chemistry projects.

Maria autonomous chemistry research

Using Maria™, we have discovered and delivered: efficient synthetic pathways, highly customized compound spaces, hit series with confirmed nM activity. Maria’s experimentally validated outputs support program decisions, manufacturing processes, and AI model development.

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Maria's capabilities include

  • Proposing synthesis reactions experiments based on prompts
  • Directing the dark, HTE Maria Lab to conduct the experiments (12K / week capacity at microliter scale)
  • Analyzing results (Liquid Chromatography, Mass Spectrometry, Ultraviolet-Visible Detection) and compiling data
  • Based on outcomes, recommend next round of experiments.
  • Coming soon: ADME-TOX

Maria Unparalleled Advantages

  • Integrated AI, dark lab and data platform operates seamlessly
  • 400,000 reaction, 40M data point proprietary reaction data is highly diverse and drives novel AI experiments
  • Lab at micro-liter scale, which allows 100x more reactions (12k / week) at the fraction of the cost in a conventional lab
  • Synthesis analysis fully automated and requires no human analytical chemists
  • Data pipeline from lab to data to AI fully automated

Contact us to learn more.

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