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Advancing drug discovery with AI, generative chemistry, and 3D molecular design

We develop cutting-edge software and AI solutions for small molecule design, optimization and data analysis. Our mission is ...

Machine learning unravels quantum atomic vibrations in materials

Caltech scientists have developed an artificial intelligence (AI)–based method that dramatically speeds up calculations of ...
Science Daily

Balancing training data and human knowledge makes AI act more like a scientist

When you teach a child how to solve puzzles, you can either let them figure it out through trial and error, or you can guide them with some basic rules and tips. Similarly, incorporating rules and ...
News Medical

Combining machine learning with statistical methods can provide accurate models for disease risk prediction

Researchers from Peking University have conducted a comprehensive systematic review on the integration of machine learning into statistical methods for disease risk prediction models, shedding light ...
TechRepublic

20+ Machine Learning Methods in Groundbreaking Periodic Table From MIT, Google, Microsoft

20+ Machine Learning Methods in Groundbreaking Periodic Table From MIT, Google, Microsoft Your email has been sent A new “periodic table for machine learning” is reshaping how researchers explore AI, ...
Michigan Technological University

Researchers Apply Machine Learning and AI in Search of Less Costly Electronic Structure Method

Electron density prediction for a four-million-atom aluminum system using machine learning, deemed to be infeasible using traditional DFT method. × Researchers from Michigan Tech and the University of ...