[gmx-users] gmx distance,umbrella sampling
jalemkul at vt.edu
Thu Nov 30 00:12:34 CET 2017
On 11/29/17 11:02 AM, rose rahmani wrote:
> would you please tell me how gmx distance calculate and write COM distance
> from .gro and .tpr files excactly?
No one can give you an "exact" command because selections will depend on
what you want to do, but in general, the syntax is here:
Justin A. Lemkul, Ph.D.
Virginia Tech Department of Biochemistry
303 Engel Hall
340 West Campus Dr.
Blacksburg, VA 24061
jalemkul at vt.edu | (540) 231-3129
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