M Scott Shell

7PUBLICATIONS
18CO-AUTHORS
Theoretical quantum chemistryComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Statistical mechanics in chemistryEcohydrologyBioinformatic methods development
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Publications (7)

|Sep 09, 2021
A microcanonical approach to temperature-transferable coarse-grained models using the relative entropy.

Evan Pretti, M Scott Shell

|Oct 22, 2020
Extrapolation and interpolation strategies for efficiently estimating structural observables as a function of temperature and density.

Jacob I Monroe, Harold W Hatch, Nathan A Mahynski

|Aug 03, 2019
A hybrid, bottom-up, structurally accurate, Go¯-like coarse-grained protein model.

Tanmoy Sanyal, Jeetain Mittal, M Scott Shell

|Dec 04, 2018
Erratum: "Evaporation-induced assembly of colloidal crystals" [J. Chem. Phys. 149, 094901 (2018)].

Michael P Howard, Wesley F Reinhart, Tanmoy Sanyal

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