2025 AIChE Annual Meeting

Session: Plenary Session: Computational Molecular Science and Engineering Forum (Invited Talks)

Plenary Session: Computational Molecular Science and Engineering Forum (Invited Talks)

Chair

Andrew Ferguson, University of Chicago

Co-Chair

Presentations

03:30 PM

(592a) Simulation Methods to Probe Rare Biophysical Processes
Harish Vashisth

04:10 PM

(592b) Modeling and Machine Learning Approaches to Protein Self-Assembly and Aggregation
Sam Lobo, Joan-Emma Shea, M. Scott Shell

04:30 PM

(592c) Multiscale Simulation Methods for Probing Structure and Dynamics of Biomolecules
Lev Levintov

04:50 PM

(592d) Building Molecular Intuition into Deep Learning Models for Small Molecule Design, Synthesis, and Analysis
Connor Coley

05:30 PM

(592e) A Theory of Emergent Phenomena in Large Language Models
Venkat Venkatasubramanian