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DTSTART;TZID=America/New_York:20250919T103000
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UID:20958-1758277800-1758282300@seasevents.nmsdev7.com
SUMMARY:[VIRTUAL SPEAKER]: Fall 2025 GRASP on Robotics: Max Welling\, University of Amsterdam & CuspAI\, "On the Role of Uncertainty in Automating the Scientific  Process with AI"
DESCRIPTION:This event will have a VIRTUAL SPEAKER. Streaming will be in-person only in Wu and Chen.  \nABSTRACT\nWe are in the middle of a transformation of the scientific process. AI is now rapidly automating scientific discovery by accelerating scientific simulation and optimisation. For example\, we can now shortcut expensive quantum mechanical calculations such as DFT with much faster machine learned interatomic potentials and forces\, numerically “solve” PDEs with neural networks\, or accelerate experimental design with Bayesian optimisation. However\, in both applications of AI the role of uncertainty is key because ML models can only be trusted in regions of input space where it has seen data. Extrapolating too far away from the data runs the risk of a large prediction error that goes unnoticed. In this talk I will first provide a high level overview of the increasingly important role of AI in science\, and then proceed with introducing a new efficient Variational Bayesian method for uncertainty quantification. I will show the effectiveness of this method on PDE solving and molecular generation (BARNN) and on ML interatomic potentials and forces (BLIP).
URL:https://seasevents.nmsdev7.com/event/virtual-speaker-fall-2025-grasp-on-robotics-max-welling-university-of-amsterdam-cuspai-on-the-role-of-uncertainty-in-automating-the-scientific-process-with-ai/
LOCATION:Wu and Chen Auditorium (Room 101)\, Levine Hall\, 3330 Walnut Street\, Philadelphia\, PA\, 19104\, United States
CATEGORIES:Seminar
ORGANIZER;CN="General Robotics%2C Automation%2C Sensing and Perception (GRASP) Lab":MAILTO:grasplab@seas.upenn.edu
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