Molecular dynamics simulation of the partitioning of benzocaine and phenytoin into a lipid bilayer

Martin, Lewis; Chao, Rebecca; Corry, Ben

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Molecular dynamics simulation of the partitioning of benzocaine and phenytoin into a lipid bilayer

Date

2014

Authors

Martin, Lewis

Chao, Rebecca

Corry, Ben

Publisher

Elsevier

Abstract

Molecular dynamics simulations were used to examine the partitioning behaviour of the local anaesthetic benzocaine and the anti-epileptic phenytoin into lipid bilayers, a factor that is critical to their mode of action. Free energy methods are used to qua

URI

http://hdl.handle.net/1885/28872

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ANU Research Publications

Source

Biophysical Chemistry

Type

Journal article

DOI

10.1016/j.bpc.2013.12.003

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2037-12-31

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Molecular dynamics simulation of the partitioning of benzocaine and phenytoin into a lipid bilayer

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