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Calculation of small molecule solvation free energy by molecular dynamics and Monte Carlo simulations.
Presenter
- Yuqing Deng
December 10, 2008
IMA
QM or MM? Development of a next-generation force field for chemical and biomolecular simulations
Presenter
- Jiali Gao
December 9, 2008
IMA
Adam Rupe - A complex systems perspective on machine learning for Earth science - IPAM at UCLA
Presenter
- Adam Rupe
February 3, 2026
IPAM
Nested Operator Inference for data-driven learning of physics-based reduced-order models
Presenter
- Nicole Aretz
November 13, 2025
IMSI
Stefan Ringe - Continuum modeling & quantum chem: Multi-scale modeling of electrochemical processes
Presenter
- Stefan Ringe
October 30, 2025
IPAM
Multiscale and Data-driven Methods for the Simulation of Materials Failure
Presenter
- James Kermode
April 11, 2024
IMSI
Juan Carlos Martinez Mori - Modeling Neighborhood Change - IPAM at UCLA
Presenter
- Juan Martinez Mori
January 24, 2024
IPAM
Bruno Correia - Exploring new molecular representations for the design of biological function
Presenter
- Bruno Correia
January 26, 2023
IPAM
Michele Ceriotti - Physical insights from atomic-scale machine learning - IPAM at UCLA
Presenter
- Michele Ceriotti
January 11, 2023
IPAM
Matteo Gori - 2nd-Quantization of Many-Body Dispersion Formalism: Modeling of Million Atom Systems
Presenter
- Matteo Gori
April 1, 2022
IPAM
Microbiome analyses through tree-based models for high-dimensional compositions
Presenter
- Li Ma
February 21, 2022
IMSI