(Q56776034)

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Extremely precise free energy calculations of amino acid side chain analogs: Comparison of common molecular mechanics force fields for proteins

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Extremely precise free energy calculations of amino acid side chain analogs: Comparison of common molecular mechanics force fields for proteins (English)

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Michael R. Shirts

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Michael R. Shirts

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4

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Vijay S. Pande

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author name string

Jed W. Pitera

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William C. Swope

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language of work or name

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publication date

15 September 2003

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Journal of Chemical Physics

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119

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11

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5740-5761

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All-atom empirical potential for molecular modeling and dynamics studies of proteins

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Modern protein force fields behave comparably in molecular dynamics simulations

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Molecular dynamics simulations of biomolecules

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Native-like mean structure in the unfolded ensemble of small proteins

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Identifiers

10.1063/1.1587119

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