[gmx-users] how to calculate the RMSD of the peptide conformation relative to the NMR structure?

Justin A. Lemkul jalemkul at vt.edu
Thu Apr 3 03:09:30 CEST 2008


Quoting fufengliu at tju.edu.cn:

> Dear everyone,
> Can somebody tell me how to calculate the RMSD of the peptide conformation
> relative to the NMR structure? Thanks again!

Try g_rms -h

-Justin

> Fufeng Liu
>
>
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========================================

Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul at vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/

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