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Dina T. Mirijanian, Ranjan V. Mannige, Ronald N. Zuckermann and Stephen Whitelam Development and use of an atomistic CHARMM-based forcefield for peptoid simulation Journal of Computational Chemistry 35

Article first published online: 29 NOV 2013 | DOI: 10.1002/jcc.23478

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Experiments and quantum mechanical calculations are used to develop an atomistic CHARMM-based forcefield for peptoids, technologically important positional isomers of peptides.

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