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Force Field Influence on the Observation of π-Helical Protein Structures in Molecular Dynamics Simulations

✍ Scribed by Feig, Michael; MacKerell,, Alexander D.; Brooks, Charles L.

Book ID: 127327093
Publisher: American Chemical Society
Year: 2003
Tongue: English
Weight: 227 KB
Volume: 107
Category: Article
ISSN: 0022-3654
DOI: 10.1021/jp027293y

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## Abstract Computational studies of proteins based on empirical force fields represent a powerful tool to obtain structure–function relationships at an atomic level, and are central in current efforts to solve the protein folding problem. The results from studies applying these tools are, however,