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Pairwise energies for polypeptide coarse-grained models derived from atomic force fields

✍ Scribed by Betancourt, Marcos R.; Omovie, Sheyore J.


Book ID
115451380
Publisher
American Institute of Physics
Year
2009
Tongue
English
Weight
735 KB
Volume
130
Category
Article
ISSN
0021-9606

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## Abstract Using the harmonic‐approximation approach of the accompanying article and AM1 energy surfaces of terminally blocked amino‐acid residues, we determined physics‐based side‐chain rotamer potentials and the side‐chain virtual‐bond‐deformation potentials of 19 natural amino‐acid residues wit