A consensus view of protein dynamics.
basic_science · Level V
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- Record sourced from PubMed, PMID 17215349.
- Also identified by PMC identifier 1783393.
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Abstract
The dynamics of proteins in aqueous solution has been investigated through a massive approach based on "state of the art" molecular dynamics simulations performed for all protein metafolds using the four most popular force fields (OPLS, CHARMM, AMBER, and GROMOS). A detailed analysis of the massive database of trajectories (>1.5 terabytes of data obtained using approximately 50 years of CPU) allowed us to obtain a robust-consensus picture of protein dynamics in aqueous solution.
Medical subject headings
- Computational Biology
- Protein Folding
- Proteins