Stretching simulation of an alpha-helical protein domain

By Markus Buehler1, Justin Riley1, Joo-Hyoung Lee2, Jeffrey C Grossman3

1. Massachusetts Institute of Technology (MIT) 2. Gwangju Institute of Science and Technology, Korea 3. Massachusetts Institute of Technology

Uses steered molecular dynamics (SMD) to apply a tensile load to the ends of a molecule (such as an alpha-helical protein domain)

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Version 1.0w - published on 19 Mar 2015

doi:10.4231/D3M90241X cite this

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