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Accelerated Molecular Dynamics and Protein Conformational Change: A Theoretical and Practical Guide Using a Membrane Embedded Model Neurotransmitter Transporter

Molecular dynamics simulation provides a powerful and accurate method to model protein conformational change, yet timescale limitations often prevent direct assessment of the kinetic properties of interest. A large number of molecular dynamic steps are necessary for rare events to occur, which allow...

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Bibliografiset tiedot
Julkaisussa:Methods Mol Biol
Päätekijät: Gedeon, Patrick C., Thomas, James R., Madura, Jeffry D.
Aineistotyyppi: Artigo
Kieli:Inglês
Julkaistu: 2015
Aiheet:
Linkit:https://ncbi.nlm.nih.gov/pmc/articles/PMC4518716/
https://ncbi.nlm.nih.gov/pubmed/25330967
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/978-1-4939-1465-4_12
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