Publications by authors named "Lester Hedges"

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Enhancing Electrostatic Embedding for ML/MM Free Energy Calculations.
João Morado, Kirill Zinovjev, Lester O Hedges, Daniel J Cole, Julien Michel

J Chem Theory Comput· November 2025

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: A Flexible Electrostatic Machine Learning Embedding Package for Multiscale Molecular Dynamics Simulations.
Kirill Zinovjev, Lester Hedges, Rubén Montagud Andreu, Christopher Woods, Iñaki Tuñón

J Chem Theory Comput· June 2024

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Sire: An interoperability engine for prototyping algorithms and exchanging information between molecular simulation programs.
Christopher J Woods, Lester O Hedges, Adrian J Mulholland, Maturos Malaisree, Paolo Tosco

J Chem Phys· May 2024

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Crystallization and arrest mechanisms of model colloids.
Thomas K Haxton, Lester O Hedges, Stephen Whitelam

Soft Matter· December 2015

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Growth of equilibrium structures built from a large number of distinct component types.
Lester O Hedges, Ranjan V Mannige, Stephen Whitelam

Soft Matter· September 2014

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Self-assembly at a nonequilibrium critical point.
Stephen Whitelam, Lester O Hedges, Jeremy D Schmit

Phys Rev Lett· April 2014

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Uncovering the intrinsic size dependence of hydriding phase transformations in nanocrystals.
Rizia Bardhan, Lester O Hedges, Cary L Pint, Ali Javey, Stephen Whitelam

Nat Mater· October 2013

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Microscopic evidence for liquid-liquid separation in supersaturated CaCO3 solutions.
Adam F Wallace, Lester O Hedges, Alejandro Fernandez-Martinez, Paolo Raiteri, Julian D Gale

Science· August 2013

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Self-assembly of multicomponent structures in and out of equilibrium.
Stephen Whitelam, Rebecca Schulman, Lester Hedges

Phys Rev Lett· December 2012

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Preparation and relaxation of very stable glassy states of a simulated liquid.
Robert L Jack, Lester O Hedges, Juan P Garrahan, David Chandler

Phys Rev Lett· December 2011

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Limit of validity of Ostwald's rule of stages in a statistical mechanical model of crystallization.
Lester O Hedges, Stephen Whitelam

J Chem Phys· October 2011

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Dynamic order-disorder in atomistic models of structural glass formers.
Lester O Hedges, Robert L Jack, Juan P Garrahan, David Chandler

Science· March 2009

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Decoupling of exchange and persistence times in atomistic models of glass formers.
Lester O Hedges, Lutz Maibaum, David Chandler, Juan P Garrahan

J Chem Phys· December 2007

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