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The Journal of Physical Chemistry. B|March 27, 2025
Characterizing the Sequence Landscape of Peptide Fibrillization with a Bottom-Up Coarse-Grained ModelEvan Pretti, M Scott ShellThe Journal of Chemical Physics|September 9, 2021
A microcanonical approach to temperature-transferable coarse-grained models using the relative entropyEvan Pretti, M Scott ShellProceedings of the National Academy of Sciences of the United States of America|November 20, 2023
Mapping the configurational landscape and aggregation phase behavior of the tau protein fragment PHF6Evan Pretti, M Scott ShellThe Journal of Chemical Physics|September 4, 2012
Systematic coarse-graining of potential energy landscapes and dynamics in liquidsM Scott ShellThe Journal of Chemical Physics|December 3, 2008
The relative entropy is fundamental to multiscale and inverse thermodynamic problemsM Scott ShellACS Nano|May 3, 2021
Temperature-Controlled Reconfigurable Nanoparticle Binary SuperlatticesRunfang Mao, Evan Pretti, Jeetain MittalPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|September 28, 2010
Relative entropy as a universal metric for multiscale errorsAviel Chaimovich, M Scott ShellThe Journal of Chemical Physics|February 17, 2011
Two-dimensional replica exchange approach for peptide-peptide interactionsJason Gee, M Scott ShellThe Journal of Chemical Physics|March 10, 2011
Coarse-graining errors and numerical optimization using a relative entropy frameworkAviel Chaimovich, M Scott ShellBiophysical Journal|July 10, 2012
Charge effects on the fibril-forming peptide KTVIIE: a two-dimensional replica exchange simulation studyJoohyun Jeon, M Scott ShellPageof 11