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Dynamics of activated processes in globular proteins.

A procedure for the dynamical simulation of activated processes, such as ligand binding and enzymatic reactions, in a globular protein is outlined. Preliminary calculations of the transition state geometry and barrier crossing trajectories are presented for a model reaction, the rotation of an aroma...

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Main Authors: McCammon, J A, Karplus, M
格式: Artigo
語言:Inglês
出版: 1979
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在線閱讀:https://ncbi.nlm.nih.gov/pmc/articles/PMC383876/
https://ncbi.nlm.nih.gov/pubmed/291026
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