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Gregory Voth
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Theory of Coarse-Graining and Multiscale Phenomena
Charge Transport
Renewable Energy Materials
Simulations of Biomolecular Systems
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Software: RAPTOR
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Journal Article
Dama JF
,
Hocky GM
,
Sun R
,
Voth GA
.
Exploring Valleys Without Climbing Every Peak: More Efficient and Forgiving Metabasin Metadynamics via Robust On-the-Fly Bias Domain Restriction
. J. Chem. Theory Comp. 2015 .
DOI