[gmx-users] HBonds between molecules

Hovakim Grabski hovakim_grabski at yahoo.com
Sun Mar 18 14:40:40 CET 2012


Dear Gromacs users,
I ran a simulation with 13 Hypericin molecules in water for 10 ns and 7 of them formed an aggregate.Is there any way to find out between what molecules and atoms Hbonds were formed?
Thanks in advance

Hovakim Grabski
Russian-Armenian(Slavonic) University
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