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Artificial Intelligence (AI) and robotics are revolutionizing the landscape of research, transforming the way we approach problem-solving and knowledge discovery.
Where can technology have the largest impact in drug discovery?
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Our Growth & Reach
700+
160+
39
10,000m2+
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our story
From quantum physics to drug discovery
In 2015, three MIT postdoctoral physicists met over pizza for a late-night brainstorming session. They discussed the untapped potential of quantum-physics in drug discovery, dreaming of a new era in science. They shared a vision: To revolutionize crystal structure prediction & transform drug research.
The success of their CSP platform, proven to have industry-leading accuracy in a blind test by Pfizer, kickstarted a period of rapid growth and ultimately paved the way for a pivotal collaboration in bringing Paxlovid to the market during the COVID-19 pandemic.
What started with crystal structure prediction has ignited a transformative journey in drug research, biotechnology, and materials science using AI, quantum physics, and robotics.
We don’t just adapt to trends: we create them, relentlessly driving the evolution of science and technology.
Our History
2015
XtalPi founded in Boston, MA
Started crystal structure prediction and drug research services
Initiatied solid-state research solutions
- Completed series B+ financing
2016
Established AI R&D Center
Built CSP platform for crystal form prediction
- Completed series A financing
2017
Launched AI-powered drug discovery platform
Started Partnerships with leading pharma companies to provide polymorph screening and selection service
- Completed series B financing
2018
Developed high precision force field platform XFF and free energy perturbation calculation solution XFEP
Established wet lab facilities for solid-state R&D, systhesis and experimental research
- Completed series B+ financing
2019
Initiated drug discovery platform project for antibody, peptide & protein therapeutics
- Completed series B++ financing
2020
Started R&D of automation laboratory
Completed proof test of prototype machine of the automation station