[gmx-users] distance between two groups

Qasim Pars qasimpars at gmail.com
Wed Jun 8 02:12:30 CEST 2016


Dear gmx users,

How can I calculate the distance between the central of mass of two groups
( for example: ligand and protein)? As far as I understand gmx mindist does
not do it.

And is that possible to calculate the distance per residue as a function of
time? I would like to calculate the distance between ligand and each
residue as a function of time.

Cheers,

-- 
Qasim Pars


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