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Journal of the American Chemical Society|September 21, 2007
Role of surface dimer dynamics in creating ordered organic-semiconductor interfacesRobin L Hayes, Mark E TuckermanJournal of Chemical Theory and Computation|November 21, 2015
Free Energy Reconstruction from Metadynamics or Adiabatic Free Energy Dynamics SimulationsMichel A Cuendet, Mark E TuckermanPhysical Review Letters|January 11, 2020
Neural-Network-Based Path Collective Variables for Enhanced Sampling of Phase TransformationsJutta Rogal, Elia Schneider, Mark E TuckermanJournal of Chemical Theory and Computation|November 16, 2020
Molecular Dynamics with Very Large Time Steps for the Calculation of Solvation Free EnergiesCharlles R A Abreu, Mark E TuckermanProceedings of the National Academy of Sciences of the United States of America|May 5, 2005
Ab initio molecular dynamics: concepts, recent developments, and future trendsRadu Iftimie, Peter Minary, Mark E TuckermanPhysical Review Letters|October 13, 2007
Connecting solvation shell structure to proton transport kinetics in hydrogen-bonded networks via population correlation functionsAmalendu Chandra, Mark E Tuckerman, Dominik MarxThe Journal of Chemical Physics|August 3, 2012
Ab initio molecular dynamics study of water at constant pressure using converged basis sets and empirical dispersion correctionsZhonghua Ma, Yanli Zhang, Mark E TuckermanBiotechnology Letters|August 9, 2005
A Pitfall of the 3-(4,5-dimethylthiazol-2-yl)-5(3-carboxymethonyphenol)-2-(4-sulfophenyl)-2H-tetrazolium (MTS) assay due to evaporation in wells on the edge of a 96 well plateManish I Patel, Rodney Tuckerman, Qihan DongJournal of Chemical Theory and Computation|December 3, 2015
Alchemical Variations of Intermolecular Energies According to Molecular Grand-Canonical Ensemble Density Functional TheoryO Anatole von Lilienfeld, M E TuckermanAccounts of Chemical Research|February 24, 2006
Structure and dynamics of OH-(aq)Mark E Tuckerman, Amalendu Chandra, Dominik MarxPageof 28