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Understanding the mechanisms of proton transport in hydrogen bonded media from first-principle molecular dynamics
Presenter
- Mark Tuckerman
November 8, 2013
IPAM
Enhanced sampling in molecular dynamics: Targeting specific collective variables
Presenter
- Mark Tuckerman
September 10, 2013
IPAM
Enhanced sampling in molecular dynamics: Unbiased approaches
Presenter
- Mark Tuckerman
September 11, 2013
IPAM
Exploration and learning of energy and free energy landscapes
Presenter
- Mark Tuckerman
November 2, 2017
IPAM
Exploration and learning of free energy landscapes of molecular crystals and oligopeptides
Presenter
- Mark Tuckerman
October 26, 2016
IPAM
Ab initio path-integrals and specific applications of the Car-Parrinello approach to problems of aqueous ion solvation and transport
Presenter
- Mark Tuckerman
December 7, 2008
IMA
Ab initio molecular dynamics via the Car-Parrinello method: Basic ideas, theory, and algorithms
Presenter
- Mark Tuckerman
December 7, 2008
IMA