[gmx-users] g_hbond - which atoms?

David van der Spoel spoel at xray.bmc.uu.se
Tue Sep 21 12:59:17 CEST 2004

On Tue, 2004-09-21 at 12:20, Samantha Kaye wrote:
> How do I get g_hbond (or something else if I'm using the wrong program)
> to tell me which atoms are forming each h-bond? Is that possible?
Yes, you can print out an index file with flag -hbn
> Sam
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David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel

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