[gmx-users] Finding H-Bond donor-acceptor pairs
reach.anirban.ghosh at gmail.com
Thu Jan 14 09:24:09 CET 2010
I was just wondering if GROMACS has any tool to list out the hydrogen bond
donor-acceptor pairs (in terms of residue names/numbers) throughout a MD
simulation, say 10 ns. Can g_hbond be used to do this or is there any other
Any suggestion is welcome.
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